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

Systemtic Name: 1-[(4-ethylphenyl)-(2-methylphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-ethylphenyl)-(o-tolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(4-ethylphenyl)-(2-methylphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4-ethylphenyl)-(2-methylphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(4-ethylphenyl)-(o-tolyl)methyl]pipecolinic acid Formula: C22H27NO2 MolecularWeight: 337.45528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CC=C2C)N3CCCCC3C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CC=C2C)N3CCCCC3C(=O)O

InChI

InChI=1S/C22H27NO2/c1-3-17-11-13-18(14-12-17)21(19-9-5-4-8-16(19)2)23-15-7-6-10-20(23)22(24)25/h4-5,8-9,11-14,20-21H,3,6-7,10,15H2,1-2H3,(H,24,25)