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

Systemtic Name: 1-[[1-(3-methylphenyl)indol-2-yl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[[1-(m-tolyl)indol-2-yl]methyl]piperidine-4-carboxylic acid CAS Name: 1-[[1-(3-methylphenyl)-2-indolyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[1-(3-methylphenyl)indol-2-yl]methyl]piperidine-4-carboxylic acid Traditional Name: 1-[[1-(m-tolyl)indol-2-yl]methyl]isonipecotic acid Formula: C22H24N2O2 MolecularWeight: 348.43816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=CC=CC=C3C=C2CN4CCC(CC4)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=CC=CC=C3C=C2CN4CCC(CC4)C(=O)O

InChI

InChI=1S/C22H24N2O2/c1-16-5-4-7-19(13-16)24-20(14-18-6-2-3-8-21(18)24)15-23-11-9-17(10-12-23)22(25)26/h2-8,13-14,17H,9-12,15H2,1H3,(H,25,26)