(4-cyanophenyl) (2S)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoate

Systemtic Name: (4-cyanophenyl) (2S)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoate Openeye Name: (4-cyanophenyl) (2S)-3-methyl-2-[(4-methylbenzoyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(4-methylphenyl)-oxomethyl]amino]butanoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) (2S)-3-methyl-2-[(4-methylbenzoyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-(p-toluoylamino)butyric acid (4-cyanophenyl) ester Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)OC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C20H20N2O3/c1-13(2)18(22-19(23)16-8-4-14(3)5-9-16)20(24)25-17-10-6-15(12-21)7-11-17/h4-11,13,18H,1-3H3,(H,22,23)/t18-/m0/s1