[4-(2-cyano-3-oxidanylidene-3-phenyl-prop-1-enyl)-2-ethoxy-phenyl] 3-methoxybenzoate

Systemtic Name: [4-(2-cyano-3-oxidanylidene-3-phenyl-prop-1-enyl)-2-ethoxy-phenyl] 3-methoxybenzoate Openeye Name: [4-(2-cyano-3-oxo-3-phenyl-prop-1-enyl)-2-ethoxy-phenyl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [4-(2-cyano-3-oxo-3-phenylprop-1-enyl)-2-ethoxyphenyl] ester IUPAC Name: [4-(2-cyano-3-oxo-3-phenylprop-1-enyl)-2-ethoxyphenyl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [4-(2-cyano-3-keto-3-phenyl-prop-1-enyl)-2-ethoxy-phenyl] ester Formula: C26H21NO5 MolecularWeight: 427.44864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)C2=CC=CC=C2)OC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)C2=CC=CC=C2)OC(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C26H21NO5/c1-3-31-24-15-18(14-21(17-27)25(28)19-8-5-4-6-9-19)12-13-23(24)32-26(29)20-10-7-11-22(16-20)30-2/h4-16H,3H2,1-2H3