(2,5-dimethylphenyl)methyl 1-(4-fluorophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: (2,5-dimethylphenyl)methyl 1-(4-fluorophenyl)carbonylpiperidine-4-carboxylate Openeye Name: (2,5-dimethylphenyl)methyl 1-(4-fluorobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxylic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 1-(4-fluorobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-fluorobenzoyl)isonipecotic acid (2,5-dimethylbenzyl) ester Formula: C22H24FNO3 MolecularWeight: 369.429263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H24FNO3/c1-15-3-4-16(2)19(13-15)14-27-22(26)18-9-11-24(12-10-18)21(25)17-5-7-20(23)8-6-17/h3-8,13,18H,9-12,14H2,1-2H3