4-[(3-methylphenyl)amino]-1-(phenylmethyl)piperidine-4-carboxylic acid

Systemtic Name: 4-[(3-methylphenyl)amino]-1-(phenylmethyl)piperidine-4-carboxylic acid Openeye Name: 1-benzyl-4-(3-methylanilino)piperidine-4-carboxylic acid CAS Name: 4-(3-methylanilino)-1-(phenylmethyl)-4-piperidinecarboxylic acid IUPAC Name: 1-benzyl-4-(3-methylanilino)piperidine-4-carboxylic acid Traditional Name: 1-benzyl-4-(m-toluidino)isonipecotic acid Formula: C20H24N2O2 MolecularWeight: 324.41676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2(CCN(CC2)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)NC2(CCN(CC2)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H24N2O2/c1-16-6-5-9-18(14-16)21-20(19(23)24)10-12-22(13-11-20)15-17-7-3-2-4-8-17/h2-9,14,21H,10-13,15H2,1H3,(H,23,24)