(2S)-2-(4-methylphenyl)-2-[(2S)-piperidin-2-yl]ethanoic acid

Systemtic Name: (2S)-2-(4-methylphenyl)-2-[(2S)-piperidin-2-yl]ethanoic acid Openeye Name: (2S)-2-[(2S)-2-piperidyl]-2-(p-tolyl)acetic acid CAS Name: (2S)-2-(4-methylphenyl)-2-[(2S)-2-piperidinyl]acetic acid IUPAC Name: (2S)-2-(4-methylphenyl)-2-[(2S)-piperidin-2-yl]acetic acid Traditional Name: (2S)-2-[(2S)-2-piperidyl]-2-(p-tolyl)acetic acid Formula: C14H19NO2 MolecularWeight: 233.30616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2CCCCN2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]([C@@H]2CCCCN2)C(=O)O

InChI

InChI=1S/C14H19NO2/c1-10-5-7-11(8-6-10)13(14(16)17)12-4-2-3-9-15-12/h5-8,12-13,15H,2-4,9H2,1H3,(H,16,17)/t12-,13-/m0/s1