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

Systemtic Name: 1-[bis(4-methylphenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-(bis-p-tolylmethyl)piperidine-3-carboxylic acid CAS Name: 1-[bis(4-methylphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[bis(4-methylphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-(bis-p-tolylmethyl)nipecotic acid Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO2/c1-15-5-9-17(10-6-15)20(18-11-7-16(2)8-12-18)22-13-3-4-19(14-22)21(23)24/h5-12,19-20H,3-4,13-14H2,1-2H3,(H,23,24)