(4-chloranyl-2-methyl-phenyl) 1-(4-fluorophenyl)carbonylpiperidine-3-carboxylate

Systemtic Name: (4-chloranyl-2-methyl-phenyl) 1-(4-fluorophenyl)carbonylpiperidine-3-carboxylate Openeye Name: (4-chloro-2-methyl-phenyl) 1-(4-fluorobenzoyl)piperidine-3-carboxylate CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-3-piperidinecarboxylic acid (4-chloro-2-methylphenyl) ester IUPAC Name: (4-chloro-2-methylphenyl) 1-(4-fluorobenzoyl)piperidine-3-carboxylate Traditional Name: 1-(4-fluorobenzoyl)nipecotic acid (4-chloro-2-methyl-phenyl) ester Formula: C20H19ClFNO3 MolecularWeight: 375.821163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H19ClFNO3/c1-13-11-16(21)6-9-18(13)26-20(25)15-3-2-10-23(12-15)19(24)14-4-7-17(22)8-5-14/h4-9,11,15H,2-3,10,12H2,1H3