(2S)-2-[(3-cyanophenyl)amino]-2-(4-methylphenyl)ethanoic acid

Systemtic Name: (2S)-2-[(3-cyanophenyl)amino]-2-(4-methylphenyl)ethanoic acid Openeye Name: (2S)-2-(3-cyanoanilino)-2-(p-tolyl)acetic acid CAS Name: (2S)-2-(3-cyanoanilino)-2-(4-methylphenyl)acetic acid IUPAC Name: (2S)-2-(3-cyanoanilino)-2-(4-methylphenyl)acetic acid Traditional Name: (2S)-2-(3-cyanoanilino)-2-(p-tolyl)acetic acid Formula: C16H14N2O2 MolecularWeight: 266.29456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)O)NC2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C(=O)O)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C16H14N2O2/c1-11-5-7-13(8-6-11)15(16(19)20)18-14-4-2-3-12(9-14)10-17/h2-9,15,18H,1H3,(H,19,20)/t15-/m0/s1