1-[(2-methylphenyl)-(3-methylphenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(2-methylphenyl)-(3-methylphenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[m-tolyl(o-tolyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2-methylphenyl)-(3-methylphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2-methylphenyl)-(3-methylphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[m-tolyl(o-tolyl)methyl]isonipecotic acid Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC=CC=C2C)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC=CC=C2C)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C21H25NO2/c1-15-6-5-8-18(14-15)20(19-9-4-3-7-16(19)2)22-12-10-17(11-13-22)21(23)24/h3-9,14,17,20H,10-13H2,1-2H3,(H,23,24)