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

Systemtic Name: 1-[(3-methylphenyl)-(4-propan-2-ylphenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(4-isopropylphenyl)-(m-tolyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(3-methylphenyl)-(4-propan-2-ylphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(3-methylphenyl)-(4-propan-2-ylphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[m-tolyl(p-cumenyl)methyl]nipecotic acid Formula: C23H29NO2 MolecularWeight: 351.48186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29NO2/c1-16(2)18-9-11-19(12-10-18)22(20-7-4-6-17(3)14-20)24-13-5-8-21(15-24)23(25)26/h4,6-7,9-12,14,16,21-22H,5,8,13,15H2,1-3H3,(H,25,26)