ethyl (E)-2-cyano-3-[[2-(phenethylcarbamoyl)phenyl]amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[[2-(phenethylcarbamoyl)phenyl]amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[2-(phenethylcarbamoyl)anilino]prop-2-enoate CAS Name: (E)-2-cyano-3-[2-[oxo-(phenethylamino)methyl]anilino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[2-(phenethylcarbamoyl)anilino]prop-2-enoate Traditional Name: (E)-2-cyano-3-[2-(phenethylcarbamoyl)anilino]acrylic acid ethyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC=CC=C1C(=O)NCCC2=CC=CC=C2)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC=CC=C1C(=O)NCCC2=CC=CC=C2)/C#N

InChI

InChI=1S/C21H21N3O3/c1-2-27-21(26)17(14-22)15-24-19-11-7-6-10-18(19)20(25)23-13-12-16-8-4-3-5-9-16/h3-11,15,24H,2,12-13H2,1H3,(H,23,25)/b17-15+