1-[(3-chlorophenyl)-(4-ethylphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3-chlorophenyl)-(4-ethylphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-chlorophenyl)-(4-ethylphenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-chlorophenyl)-(4-ethylphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-chlorophenyl)-(4-ethylphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-chlorophenyl)-(4-ethylphenyl)methyl]pipecolinic acid Formula: C21H24ClNO2 MolecularWeight: 357.87376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClNO2/c1-2-15-9-11-16(12-10-15)20(17-6-5-7-18(22)14-17)23-13-4-3-8-19(23)21(24)25/h5-7,9-12,14,19-20H,2-4,8,13H2,1H3,(H,24,25)