[4-(4-cyanophenyl)phenyl] 2-acetamido-3-methyl-butanoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 2-acetamido-3-methyl-butanoate Openeye Name: [4-(4-cyanophenyl)phenyl] 2-acetamido-3-methyl-butanoate CAS Name: 2-acetamido-3-methylbutanoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 2-acetamido-3-methylbutanoate Traditional Name: 2-acetamido-3-methyl-butyric acid [4-(4-cyanophenyl)phenyl] ester Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C#N)NC(=O)C

Isomeric SMILES

CC(C)C(C(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C#N)NC(=O)C

InChI

InChI=1S/C20H20N2O3/c1-13(2)19(22-14(3)23)20(24)25-18-10-8-17(9-11-18)16-6-4-15(12-21)5-7-16/h4-11,13,19H,1-3H3,(H,22,23)