[2-methoxy-4-[(E)-3-oxidanylidene-3-phenyl-prop-1-enyl]phenyl] 3-nitrobenzoate

Systemtic Name: [2-methoxy-4-[(E)-3-oxidanylidene-3-phenyl-prop-1-enyl]phenyl] 3-nitrobenzoate Openeye Name: [2-methoxy-4-[(E)-3-oxo-3-phenyl-prop-1-enyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-methoxy-4-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[(E)-3-keto-3-phenyl-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C23H17NO6 MolecularWeight: 403.38418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H17NO6/c1-29-22-14-16(10-12-20(25)17-6-3-2-4-7-17)11-13-21(22)30-23(26)18-8-5-9-19(15-18)24(27)28/h2-15H,1H3/b12-10+