methyl 2-[3-nitro-4-[4-(2-oxidanylidene-3,4-dihydroquinolin-1-yl)piperidin-1-yl]phenyl]carbonylbenzoate

Systemtic Name: methyl 2-[3-nitro-4-[4-(2-oxidanylidene-3,4-dihydroquinolin-1-yl)piperidin-1-yl]phenyl]carbonylbenzoate Openeye Name: methyl 2-[3-nitro-4-[4-(2-oxo-3,4-dihydroquinolin-1-yl)-1-piperidyl]benzoyl]benzoate CAS Name: 2-[[3-nitro-4-[4-(2-oxo-3,4-dihydroquinolin-1-yl)-1-piperidinyl]phenyl]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[3-nitro-4-[4-(2-oxo-3,4-dihydroquinolin-1-yl)piperidin-1-yl]benzoyl]benzoate Traditional Name: 2-[4-[4-(2-keto-3,4-dihydroquinolin-1-yl)piperidino]-3-nitro-benzoyl]benzoic acid methyl ester Formula: C29H27N3O6 MolecularWeight: 513.54118

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=O)C2=CC(=C(C=C2)N3CCC(CC3)N4C(=O)CCC5=CC=CC=C54)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(=O)C2=CC(=C(C=C2)N3CCC(CC3)N4C(=O)CCC5=CC=CC=C54)[N+](=O)[O-]

InChI

InChI=1S/C29H27N3O6/c1-38-29(35)23-8-4-3-7-22(23)28(34)20-10-12-25(26(18-20)32(36)37)30-16-14-21(15-17-30)31-24-9-5-2-6-19(24)11-13-27(31)33/h2-10,12,18,21H,11,13-17H2,1H3