[2-[[4-[(2-methoxyphenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 3-nitro-4-piperidin-1-yl-benzoate

Systemtic Name: [2-[[4-[(2-methoxyphenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 3-nitro-4-piperidin-1-yl-benzoate Openeye Name: [2-[4-[(2-methoxyphenyl)carbamoyl]anilino]-2-oxo-ethyl] 3-nitro-4-(1-piperidyl)benzoate CAS Name: 3-nitro-4-(1-piperidinyl)benzoic acid [2-[4-[(2-methoxyanilino)-oxomethyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-[(2-methoxyphenyl)carbamoyl]anilino]-2-oxoethyl] 3-nitro-4-piperidin-1-ylbenzoate Traditional Name: 3-nitro-4-piperidino-benzoic acid [2-keto-2-[4-[(2-methoxyphenyl)carbamoyl]anilino]ethyl] ester Formula: C28H28N4O7 MolecularWeight: 532.54452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)COC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)COC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C28H28N4O7/c1-38-25-8-4-3-7-22(25)30-27(34)19-9-12-21(13-10-19)29-26(33)18-39-28(35)20-11-14-23(24(17-20)32(36)37)31-15-5-2-6-16-31/h3-4,7-14,17H,2,5-6,15-16,18H2,1H3,(H,29,33)(H,30,34)