[2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl] 5-[(3-nitrophenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: [2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl] 5-[(3-nitrophenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: [2-(3-chloroanilino)-2-oxo-ethyl] 5-(3-nitroanilino)-5-oxo-pentanoate CAS Name: 5-(3-nitroanilino)-5-oxopentanoic acid [2-(3-chloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloroanilino)-2-oxoethyl] 5-(3-nitroanilino)-5-oxopentanoate Traditional Name: 5-keto-5-(3-nitroanilino)valeric acid [2-(3-chloroanilino)-2-keto-ethyl] ester Formula: C19H18ClN3O6 MolecularWeight: 419.81572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CCCC(=O)OCC(=O)NC2=CC(=CC=C2)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CCCC(=O)OCC(=O)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C19H18ClN3O6/c20-13-4-1-5-14(10-13)22-18(25)12-29-19(26)9-3-8-17(24)21-15-6-2-7-16(11-15)23(27)28/h1-2,4-7,10-11H,3,8-9,12H2,(H,21,24)(H,22,25)