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

Systemtic Name: [3-(2-cyano-3-ethoxy-3-oxidanylidene-prop-1-enyl)phenyl] 3-(4-butoxyphenyl)-2-cyano-prop-2-enoate Openeye Name: [3-(2-cyano-3-ethoxy-3-oxo-prop-1-enyl)phenyl] 3-(4-butoxyphenyl)-2-cyano-prop-2-enoate CAS Name: 3-(4-butoxyphenyl)-2-cyano-2-propenoic acid [3-(2-cyano-3-ethoxy-3-oxoprop-1-enyl)phenyl] ester IUPAC Name: [3-(2-cyano-3-ethoxy-3-oxoprop-1-enyl)phenyl] 3-(4-butoxyphenyl)-2-cyanoprop-2-enoate Traditional Name: 3-(4-butoxyphenyl)-2-cyano-acrylic acid [3-(2-cyano-3-ethoxy-3-keto-prop-1-enyl)phenyl] ester Formula: C26H24N2O5 MolecularWeight: 444.47916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)OC2=CC=CC(=C2)C=C(C#N)C(=O)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)OC2=CC=CC(=C2)C=C(C#N)C(=O)OCC

InChI

InChI=1S/C26H24N2O5/c1-3-5-13-32-23-11-9-19(10-12-23)14-22(18-28)26(30)33-24-8-6-7-20(16-24)15-21(17-27)25(29)31-4-2/h6-12,14-16H,3-5,13H2,1-2H3