1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-[(3-methylphenyl)-phenyl-methyl]piperidine-3-carboxamide

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-[(3-methylphenyl)-phenyl-methyl]piperidine-3-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-N-[m-tolyl(phenyl)methyl]piperidine-3-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-[(3-methylphenyl)-phenylmethyl]-3-piperidinecarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-[(3-methylphenyl)-phenylmethyl]piperidine-3-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)-N-[m-tolyl(phenyl)methyl]nipecotamide Formula: C27H28ClFN2O MolecularWeight: 450.975423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC=CC=C2)NC(=O)C3CCCN(C3)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC=CC=C2)NC(=O)C3CCCN(C3)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C27H28ClFN2O/c1-19-8-5-11-21(16-19)26(20-9-3-2-4-10-20)30-27(32)22-12-7-15-31(17-22)18-23-24(28)13-6-14-25(23)29/h2-6,8-11,13-14,16,22,26H,7,12,15,17-18H2,1H3,(H,30,32)