[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] (E)-2-acetamido-3-phenyl-prop-2-enoate

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] (E)-2-acetamido-3-phenyl-prop-2-enoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-ethyl] (E)-2-acetamido-3-phenyl-prop-2-enoate CAS Name: (E)-2-acetamido-3-phenyl-2-propenoic acid [2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxoethyl] (E)-2-acetamido-3-phenylprop-2-enoate Traditional Name: (E)-2-acetamido-3-phenyl-acrylic acid [2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)C(=CC2=CC=CC=C2)NC(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)/C(=C\C2=CC=CC=C2)/NC(=O)C)C

InChI

InChI=1S/C21H21NO4/c1-14-9-10-18(11-15(14)2)20(24)13-26-21(25)19(22-16(3)23)12-17-7-5-4-6-8-17/h4-12H,13H2,1-3H3,(H,22,23)/b19-12+