hexyl 4-[[(E)-2-cyano-3-phenyl-prop-2-enoyl]amino]benzoate

Systemtic Name: hexyl 4-[[(E)-2-cyano-3-phenyl-prop-2-enoyl]amino]benzoate Openeye Name: hexyl 4-[[(E)-2-cyano-3-phenyl-prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-2-cyano-1-oxo-3-phenylprop-2-enyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[[(E)-2-cyano-3-phenylprop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-2-cyano-3-phenyl-acryloyl]amino]benzoic acid hexyl ester Formula: C23H24N2O3 MolecularWeight: 376.44826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)/C(=C/C2=CC=CC=C2)/C#N

InChI

InChI=1S/C23H24N2O3/c1-2-3-4-8-15-28-23(27)19-11-13-21(14-12-19)25-22(26)20(17-24)16-18-9-6-5-7-10-18/h5-7,9-14,16H,2-4,8,15H2,1H3,(H,25,26)/b20-16+