ethyl (E)-2-cyano-3-[[4-(3-phenylpropanoylamino)phenyl]amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[[4-(3-phenylpropanoylamino)phenyl]amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[4-(3-phenylpropanoylamino)anilino]prop-2-enoate CAS Name: (E)-2-cyano-3-[4-[(1-oxo-3-phenylpropyl)amino]anilino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[4-(3-phenylpropanoylamino)anilino]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-(hydrocinnamoylamino)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=C(C=C1)NC(=O)CCC2=CC=CC=C2)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC=C(C=C1)NC(=O)CCC2=CC=CC=C2)/C#N

InChI

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