ethyl (Z)-2-cyano-3-[[3-[methyl-(phenylmethyl)carbamoyl]phenyl]amino]prop-2-enoate

Systemtic Name: ethyl (Z)-2-cyano-3-[[3-[methyl-(phenylmethyl)carbamoyl]phenyl]amino]prop-2-enoate Openeye Name: ethyl (Z)-3-[3-[benzyl(methyl)carbamoyl]anilino]-2-cyano-prop-2-enoate CAS Name: (Z)-2-cyano-3-[3-[[methyl-(phenylmethyl)amino]-oxomethyl]anilino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-[3-[benzyl(methyl)carbamoyl]anilino]-2-cyanoprop-2-enoate Traditional Name: (Z)-3-[3-[benzyl(methyl)carbamoyl]anilino]-2-cyano-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)N(C)CC2=CC=CC=C2)C#N

Isomeric SMILES

CCOC(=O)/C(=C\NC1=CC=CC(=C1)C(=O)N(C)CC2=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(2)15-16-8-5-4-6-9-16/h4-12,14,23H,3,15H2,1-2H3/b18-14-