butyl 3-[(2-cyano-3-phenyl-prop-2-enoyl)amino]benzoate

Systemtic Name: butyl 3-[(2-cyano-3-phenyl-prop-2-enoyl)amino]benzoate Openeye Name: butyl 3-[(2-cyano-3-phenyl-prop-2-enoyl)amino]benzoate CAS Name: 3-[(2-cyano-1-oxo-3-phenylprop-2-enyl)amino]benzoic acid butyl ester IUPAC Name: butyl 3-[(2-cyano-3-phenylprop-2-enoyl)amino]benzoate Traditional Name: 3-[(2-cyano-3-phenyl-acryloyl)amino]benzoic acid butyl ester Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)C(=CC2=CC=CC=C2)C#N

Isomeric SMILES

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)C(=CC2=CC=CC=C2)C#N

InChI

InChI=1S/C21H20N2O3/c1-2-3-12-26-21(25)17-10-7-11-19(14-17)23-20(24)18(15-22)13-16-8-5-4-6-9-16/h4-11,13-14H,2-3,12H2,1H3,(H,23,24)