[3-[(E)-2-cyano-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl] 4-(2-oxidanylidene-2-phenyl-ethanoyl)benzoate

Systemtic Name: [3-[(E)-2-cyano-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl] 4-(2-oxidanylidene-2-phenyl-ethanoyl)benzoate Openeye Name: [3-[(E)-2-cyano-3-methoxy-3-oxo-prop-1-enyl]phenyl] 4-(2-oxo-2-phenyl-acetyl)benzoate CAS Name: 4-(1,2-dioxo-2-phenylethyl)benzoic acid [3-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [3-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] 4-(2-oxo-2-phenylacetyl)benzoate Traditional Name: 4-(2-keto-2-phenyl-acetyl)benzoic acid [3-[(E)-2-cyano-3-keto-3-methoxy-prop-1-enyl]phenyl] ester Formula: C26H17NO6 MolecularWeight: 439.41628

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC(=CC=C1)OC(=O)C2=CC=C(C=C2)C(=O)C(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

COC(=O)/C(=C/C1=CC(=CC=C1)OC(=O)C2=CC=C(C=C2)C(=O)C(=O)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C26H17NO6/c1-32-25(30)21(16-27)14-17-6-5-9-22(15-17)33-26(31)20-12-10-19(11-13-20)24(29)23(28)18-7-3-2-4-8-18/h2-15H,1H3/b21-14+