[4-[2-cyano-3-oxidanylidene-3-[(2,4,6-trimethylphenyl)amino]prop-1-enyl]-2-ethoxy-phenyl] benzoate

Systemtic Name: [4-[2-cyano-3-oxidanylidene-3-[(2,4,6-trimethylphenyl)amino]prop-1-enyl]-2-ethoxy-phenyl] benzoate Openeye Name: [4-[2-cyano-3-oxo-3-(2,4,6-trimethylanilino)prop-1-enyl]-2-ethoxy-phenyl] benzoate CAS Name: benzoic acid [4-[2-cyano-3-oxo-3-(2,4,6-trimethylanilino)prop-1-enyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[2-cyano-3-oxo-3-(2,4,6-trimethylanilino)prop-1-enyl]-2-ethoxyphenyl] benzoate Traditional Name: benzoic acid [4-(2-cyano-3-keto-3-mesidino-prop-1-enyl)-2-ethoxy-phenyl] ester Formula: C28H26N2O4 MolecularWeight: 454.51704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=C(C=C(C=C2C)C)C)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=C(C=C(C=C2C)C)C)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H26N2O4/c1-5-33-25-16-21(11-12-24(25)34-28(32)22-9-7-6-8-10-22)15-23(17-29)27(31)30-26-19(3)13-18(2)14-20(26)4/h6-16H,5H2,1-4H3,(H,30,31)