(3S)-1-[(4-methoxy-3-methyl-phenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name: (3S)-1-[(4-methoxy-3-methyl-phenyl)methyl]piperidine-3-carboxylic acid Openeye Name: (3S)-1-[(4-methoxy-3-methyl-phenyl)methyl]piperidine-3-carboxylic acid CAS Name: (3S)-1-[(4-methoxy-3-methylphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: (3S)-1-[(4-methoxy-3-methylphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: (3S)-1-(4-methoxy-3-methyl-benzyl)nipecotic acid Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CN2CCCC(C2)C(=O)O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)CN2CCC[C@@H](C2)C(=O)O)OC

InChI

InChI=1S/C15H21NO3/c1-11-8-12(5-6-14(11)19-2)9-16-7-3-4-13(10-16)15(17)18/h5-6,8,13H,3-4,7,9-10H2,1-2H3,(H,17,18)/t13-/m0/s1