1-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-nitrophenyl)-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-nitrophenyl)-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(3-nitrophenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(3-nitrophenyl)-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-5-one IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-(3-nitrophenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 1-homoveratryl-3-hydroxy-5-(3-nitrophenyl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C29H26N2O7 MolecularWeight: 514.52594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(C(=C(C2=O)O)C(=O)C=CC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(C(=C(C2=O)O)C(=O)/C=C/C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C29H26N2O7/c1-37-24-14-12-20(17-25(24)38-2)15-16-30-27(21-9-6-10-22(18-21)31(35)36)26(28(33)29(30)34)23(32)13-11-19-7-4-3-5-8-19/h3-14,17-18,27,33H,15-16H2,1-2H3/b13-11+