prop-2-enyl (E)-2-cyano-3-[3-[(4-methylphenyl)carbonylamino]phenyl]prop-2-enoate

Systemtic Name: prop-2-enyl (E)-2-cyano-3-[3-[(4-methylphenyl)carbonylamino]phenyl]prop-2-enoate Openeye Name: allyl (E)-2-cyano-3-[3-[(4-methylbenzoyl)amino]phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[3-[[(4-methylphenyl)-oxomethyl]amino]phenyl]-2-propenoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (E)-2-cyano-3-[3-[(4-methylbenzoyl)amino]phenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[3-(p-toluoylamino)phenyl]acrylic acid allyl ester Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C=C(C#N)C(=O)OCC=C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)/C=C(\C#N)/C(=O)OCC=C

InChI

InChI=1S/C21H18N2O3/c1-3-11-26-21(25)18(14-22)12-16-5-4-6-19(13-16)23-20(24)17-9-7-15(2)8-10-17/h3-10,12-13H,1,11H2,2H3,(H,23,24)/b18-12+