[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl] (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate

Systemtic Name: [2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl] (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate Openeye Name: [2-(4-ethylanilino)-2-oxo-ethyl] (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-ethoxyphenyl)-2-propenoic acid [2-(4-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-ethylanilino)-2-oxoethyl] (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-p-phenetyl-acrylic acid [2-(4-ethylanilino)-2-keto-ethyl] ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)COC(=O)C(=CC2=CC=C(C=C2)OCC)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)COC(=O)/C(=C/C2=CC=C(C=C2)OCC)/C#N

InChI

InChI=1S/C22H22N2O4/c1-3-16-5-9-19(10-6-16)24-21(25)15-28-22(26)18(14-23)13-17-7-11-20(12-8-17)27-4-2/h5-13H,3-4,15H2,1-2H3,(H,24,25)/b18-13+