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

Systemtic Name: 1-[(4-methylphenyl)-phenyl-methyl]piperidine-3-carboxylic acid Openeye Name: 1-[phenyl(p-tolyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(4-methylphenyl)-phenylmethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(4-methylphenyl)-phenylmethyl]piperidine-3-carboxylic acid Traditional Name: 1-[phenyl(p-tolyl)methyl]nipecotic acid Formula: C20H23NO2 MolecularWeight: 309.40212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCCC(C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C20H23NO2/c1-15-9-11-17(12-10-15)19(16-6-3-2-4-7-16)21-13-5-8-18(14-21)20(22)23/h2-4,6-7,9-12,18-19H,5,8,13-14H2,1H3,(H,22,23)