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

Systemtic Name: [4-[2-cyano-3-(4-methylphenyl)-3-oxidanylidene-prop-1-enyl]-2-ethoxy-phenyl] 3-methoxybenzoate Openeye Name: [4-[2-cyano-3-oxo-3-(p-tolyl)prop-1-enyl]-2-ethoxy-phenyl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [4-[2-cyano-3-(4-methylphenyl)-3-oxoprop-1-enyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[2-cyano-3-(4-methylphenyl)-3-oxoprop-1-enyl]-2-ethoxyphenyl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [4-[2-cyano-3-keto-3-(p-tolyl)prop-1-enyl]-2-ethoxy-phenyl] ester Formula: C27H23NO5 MolecularWeight: 441.47522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H23NO5/c1-4-32-25-15-19(14-22(17-28)26(29)20-11-8-18(2)9-12-20)10-13-24(25)33-27(30)21-6-5-7-23(16-21)31-3/h5-16H,4H2,1-3H3