methyl 4-[3-[(4-nitrophenyl)carbonyl-prop-2-enyl-amino]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate

Systemtic Name: methyl 4-[3-[(4-nitrophenyl)carbonyl-prop-2-enyl-amino]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: methyl 4-[3-[allyl-(4-nitrobenzoyl)amino]-2,5-dioxo-pyrrolidin-1-yl]benzoate CAS Name: 4-[3-[[(4-nitrophenyl)-oxomethyl]-prop-2-enylamino]-2,5-dioxo-1-pyrrolidinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[(4-nitrobenzoyl)-prop-2-enylamino]-2,5-dioxopyrrolidin-1-yl]benzoate Traditional Name: 4-[3-[allyl-(4-nitrobenzoyl)amino]-2,5-diketo-pyrrolidino]benzoic acid methyl ester Formula: C22H19N3O7 MolecularWeight: 437.40216

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CC=C)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CC=C)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O7/c1-3-12-23(20(27)14-4-10-17(11-5-14)25(30)31)18-13-19(26)24(21(18)28)16-8-6-15(7-9-16)22(29)32-2/h3-11,18H,1,12-13H2,2H3