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

Systemtic Name: methyl (E)-2-cyano-3-[[4-(3-phenylpropanoylamino)phenyl]amino]prop-2-enoate Openeye Name: methyl (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 methyl ester IUPAC Name: methyl (E)-2-cyano-3-[4-(3-phenylpropanoylamino)anilino]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-(hydrocinnamoylamino)anilino]acrylic acid methyl ester Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CNC1=CC=C(C=C1)NC(=O)CCC2=CC=CC=C2)C#N

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O3/c1-26-20(25)16(13-21)14-22-17-8-10-18(11-9-17)23-19(24)12-7-15-5-3-2-4-6-15/h2-6,8-11,14,22H,7,12H2,1H3,(H,23,24)/b16-14+