ethyl 4-[3-[(3-nitrophenyl)carbonyl-phenethyl-amino]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate

Systemtic Name: ethyl 4-[3-[(3-nitrophenyl)carbonyl-phenethyl-amino]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: ethyl 4-[3-[(3-nitrobenzoyl)-phenethyl-amino]-2,5-dioxo-pyrrolidin-1-yl]benzoate CAS Name: 4-[3-[[(3-nitrophenyl)-oxomethyl]-phenethylamino]-2,5-dioxo-1-pyrrolidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-[(3-nitrobenzoyl)-phenethylamino]-2,5-dioxopyrrolidin-1-yl]benzoate Traditional Name: 4-[2,5-diketo-3-[(3-nitrobenzoyl)-phenethyl-amino]pyrrolidino]benzoic acid ethyl ester Formula: C28H25N3O7 MolecularWeight: 515.514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CCC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CCC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H25N3O7/c1-2-38-28(35)20-11-13-22(14-12-20)30-25(32)18-24(27(30)34)29(16-15-19-7-4-3-5-8-19)26(33)21-9-6-10-23(17-21)31(36)37/h3-14,17,24H,2,15-16,18H2,1H3