Free Chemical Databases
-
[Synonyms]
NSC409600
[Structure]
[ Properties Computed from Structure]
Molecular Weight 557.50916 [g/mol] Molecular Formula C32H19N3O7 H-Bond Donor 0 H-Bond Acceptor 7 Rotatable Bond Count 0 Exact Mass 557.1223 MonoIsotopic Mass 557.1223 Topological Polar Surface Area 147 Heavy Atom Count 42 Formal Charge 0 Complexity 883 Isotope Atom Count 0 Defined Atom StereoCenter Count 0 Undefined Atom StereoCenter Count 0 Defined Bond StereoCenter Count 0 Undefined Bond StereoCenter Count 0 Covalently-Bonded Unit Count 2
[ Descriptors Computed from Structure]
IUPAC Name: 12-methylbenzo[a]anthracene; 2,4,7-trinitrofluoren-9-one
Canonical SMILES: CC1=C2C(=CC3=CC=CC=C13)C=CC4=CC=CC=C42.C1=CC2=C(C=C1[N+](=O)[O-])C(=O)
C3=CC(=CC(=C23)[N+](=O)[O-])[N+](=O)[O-]
InChI: InChI=1/C19H14.C13H5N3O7/c1-13-17-8-4-3-7-15(17)12-16-11-10-14-6-2-5-9-
18(14)19(13)16;17-13-9-3-6(14(18)19)1-2-8(9)12-10(13)4-7(15(20)21)5-11
(12)16(22)23/h2-12H,1H3;1-5H
Other Chemicals
- EINECS 260-204-2,N-Ethyl-2-isopropylcycloheptanecarboxamide,56471-43-3,
- Oxarsanilic acid,Phenol-p-arsonic acid,4-Hydroxyphenylarsonic acid,Phenol-para-arsonic acid,p-Hydroxybenzenear
- Butanserin ,Butanserin [INN],Butanserine [French],Butanserinum [Latin],Butanserina [Spanish],PDSP1_000836,PDSP
- 3-METHYLTHIOPHENE,3-Thiotolene,Thiophene, 3-methyl-,beta-Methylthiophene,Poly(3-methylthiophene) ,P3MT ,CCRIS
- 4-Hexanoylresorcinol,MLS000774909,2',4'-Dihydroxyhexanophenone,nchembio.2007.32-comp10,209473_ALDRICH,
- 1,5-Di(p-aminophenoxy)pentane ,1,5-Bis(p-aminophenoxy)pentane ,M&B 968A ,ZINC02039941,4,4'-(1,5-Pentanediy
- BRN 0840052,LS-140910,2-(Fluoromethyl)-3-(2-methylphenyl)-6-nitro-4(3H)-quinazolinone,4(3H)-Quinazolinone, 2-(
- BMS-186318 analog 19,NH(CH2CHOHNHCOOH)2 deriv.,AIDS028382,AIDS097363,BMS-186318 ,AIDS-028382,AIDS-097363,BMS 1
- 3'-Nitro-3-biphenylamine,3-Amino-3'-nitrobiphenyl,3-BIPHENYLAMINE, 3'-NITRO-,BRN 2111610,LS-44151,
- Methyl 2,3-dichloropropionate,Methyl 2,3-dichloropropanoate,442656_SUPELCO,NSC9373,Methyl alpha,beta-dichlorop
- CBMicro_016349,1-Cyclohexylamino-anthraquinone,1-(Cyclohexylaminoanthraquinone),EINECS 214-143-3,STK238278,ZIN
- N-Demethylencainide ,ND Encainide ,N-Desmethylenecainide ,MJ 11081,LS-27150,(+-)-4-Methoxy-N-(2-(2-(2-piperidi
- 4-(Dimethylamino)methyl-3-methoxydibenzofuran,LS-61056,DIBENZOFURAN, 4-(DIMETHYLAMINO)METHYL-3-METHOXY-,42840-
- Per-O-methyl-alpha-D-glucose,EINECS 210-096-8,Methyl tetra-O-methyl-alpha-D-g;ucopyranoside,Methyl 2,3,4,6-tet
- 2-Deoxyxanthosine,2'-Deoxyxanthosine ,Xanthosine, 2'-deoxy-,25843-96-3,29049-22-7,
- Laidlomycin ,Laidlomycine [INN-French],Laidlomycinum [INN-Latin],Laidlomicina [INN-Spanish],Laidlomycin [INN:B
- IUPAC Name: 3-chloro-6-(hydroxymethyl)oxane-2,4,5-triol,Canonical SMILES: C(C1C(C(C(C(O1)O)Cl)O)O)O,InChI: InC
- Albamycin Syrup,Novobiocin, calcium salt,NOVOBIOCIN CALCIUM ,EINECS 224-321-2,303-81-1,4309-70-0,Benzamide, N-
- 9-Butyl-9H-carbazole,9H-Carbazole, 9-butyl-,NSC70992,EINECS 216-051-9,ZINC01696582,BAS 00287975,AI3-14685,ST52
- POLYOXYL 25 GLYCERYL TRIOLEATE,228412-89-3,68958-64-5,Poly(oxy-1,2-ethanediyl), alpha,alpha',alpha'
- Norflurane ,Khladon 134a,Refrigerant R134a,Arcton 134a,Norflurane (USAN),Fron 134a,sGPBAHJPtaYCHiCUP@,Norflura
- IUPAC Name: (2-chlorophenyl)methyl-[[4-[[(2-chlorophenyl)methylamino]methyl],cyclohexyl]methyl]-dimethylazaniu
- EINECS 241-666-4,Phenyl beta-D-glucopyranosiduronic acid,17685-05-1,
- IUPAC Name: N-methyl-3-(1-phenylisochroman-1-yl)propan-1-amine,Canonical SMILES: CNCCCC1(C2=CC=CC=C2CCO1)C3=CC
- Cyclohexene, 1-chloro-,1-CHLOROCYCLOHEXENE,NSC148275,Cyclohexene, 1-chloro- (8CI)(9CI),NSC 148275,InChI=1/C6H9
- IUPAC Name: N',3,4,5-tetrahydroxybenzenecarboximidamide,Canonical SMILES: C1=C(C=C(C(=C1O)O)O)C(=NO)N,InChI: I
- BRN 4947381,LS-140657,4(3H)-Quinazolinone, 6,8-dibromo-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-,6,8-Di
- 5-Allylfurfuryl chrysanthemate,LS-58674,2,2-Dimethyl-3-(2-methylpropenyl)cyclopropanecarboxylic acid 5-allylfu