ethyl (Z)-2-cyano-3-[[3-(1-phenylethylcarbamoyl)phenyl]amino]prop-2-enoate

Systemtic Name: ethyl (Z)-2-cyano-3-[[3-(1-phenylethylcarbamoyl)phenyl]amino]prop-2-enoate Openeye Name: ethyl (Z)-2-cyano-3-[3-(1-phenylethylcarbamoyl)anilino]prop-2-enoate CAS Name: (Z)-2-cyano-3-[3-[oxo-(1-phenylethylamino)methyl]anilino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-cyano-3-[3-(1-phenylethylcarbamoyl)anilino]prop-2-enoate Traditional Name: (Z)-2-cyano-3-[3-(1-phenylethylcarbamoyl)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(=C1)C(=O)NC(C)C2=CC=CC=C2)C#N

Isomeric SMILES

CCOC(=O)/C(=C\NC1=CC=CC(=C1)C(=O)NC(C)C2=CC=CC=C2)/C#N

InChI

InChI=1S/C21H21N3O3/c1-3-27-21(26)18(13-22)14-23-19-11-7-10-17(12-19)20(25)24-15(2)16-8-5-4-6-9-16/h4-12,14-15,23H,3H2,1-2H3,(H,24,25)/b18-14-