1-[(3,5-dimethylphenyl)-(2-fluorophenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3,5-dimethylphenyl)-(2-fluorophenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3,5-dimethylphenyl)-(2-fluorophenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3,5-dimethylphenyl)-(2-fluorophenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3,5-dimethylphenyl)-(2-fluorophenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3,5-dimethylphenyl)-(2-fluorophenyl)methyl]pipecolinic acid Formula: C21H24FNO2 MolecularWeight: 341.419163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(C2=CC=CC=C2F)N3CCCCC3C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(C2=CC=CC=C2F)N3CCCCC3C(=O)O)C

InChI

InChI=1S/C21H24FNO2/c1-14-11-15(2)13-16(12-14)20(17-7-3-4-8-18(17)22)23-10-6-5-9-19(23)21(24)25/h3-4,7-8,11-13,19-20H,5-6,9-10H2,1-2H3,(H,24,25)