(4-cyanophenyl)methyl 2-benzamido-3-methyl-butanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=C(C=C1)C#N)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)OCC1=CC=C(C=C1)C#N)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H20N2O3/c1-14(2)18(22-19(23)17-6-4-3-5-7-17)20(24)25-13-16-10-8-15(12-21)9-11-16/h3-11,14,18H,13H2,1-2H3,(H,22,23)