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

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

Isomeric SMILES

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

InChI

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