[2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] (E)-3-(2-methylphenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] (E)-3-(2-methylphenyl)prop-2-enoate Openeye Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] (E)-3-(o-tolyl)prop-2-enoate CAS Name: (E)-3-(2-methylphenyl)-2-propenoic acid [2-oxo-2-[4-(1-oxopropylamino)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] (E)-3-(2-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(o-tolyl)acrylic acid [2-keto-2-(4-propionamidophenyl)ethyl] ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C=CC2=CC=CC=C2C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)/C=C/C2=CC=CC=C2C

InChI

InChI=1S/C21H21NO4/c1-3-20(24)22-18-11-8-17(9-12-18)19(23)14-26-21(25)13-10-16-7-5-4-6-15(16)2/h4-13H,3,14H2,1-2H3,(H,22,24)/b13-10+