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

Systemtic Name: [4-[(E)-2-cyano-3-ethoxy-3-oxidanylidene-prop-1-enyl]-2-ethoxy-phenyl] (E)-2-cyano-3-(4-propoxyphenyl)prop-2-enoate Openeye Name: [4-[(E)-2-cyano-3-ethoxy-3-oxo-prop-1-enyl]-2-ethoxy-phenyl] (E)-2-cyano-3-(4-propoxyphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-propoxyphenyl)-2-propenoic acid [4-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-2-ethoxyphenyl] (E)-2-cyano-3-(4-propoxyphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-propoxyphenyl)acrylic acid [4-[(E)-2-cyano-3-ethoxy-3-keto-prop-1-enyl]-2-ethoxy-phenyl] ester Formula: C27H26N2O6 MolecularWeight: 474.50514

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)OC2=C(C=C(C=C2)C=C(C#N)C(=O)OCC)OCC

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)OC2=C(C=C(C=C2)/C=C(\C#N)/C(=O)OCC)OCC

InChI

InChI=1S/C27H26N2O6/c1-4-13-34-23-10-7-19(8-11-23)14-22(18-29)27(31)35-24-12-9-20(16-25(24)32-5-2)15-21(17-28)26(30)33-6-3/h7-12,14-16H,4-6,13H2,1-3H3/b21-15+,22-14+