(phenylmethyl) 4-(4-fluorophenyl)-3-[(4-methylphenyl)sulfonyloxymethyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(4-fluorophenyl)-3-[(4-methylphenyl)sulfonyloxymethyl]piperidine-1-carboxylate Openeye Name: benzyl 4-(4-fluorophenyl)-3-(p-tolylsulfonyloxymethyl)piperidine-1-carboxylate CAS Name: 4-(4-fluorophenyl)-3-[(4-methylphenyl)sulfonyloxymethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(4-fluorophenyl)-3-[(4-methylphenyl)sulfonyloxymethyl]piperidine-1-carboxylate Traditional Name: 4-(4-fluorophenyl)-3-(tosyloxymethyl)piperidine-1-carboxylic acid benzyl ester Formula: C27H28FNO5S MolecularWeight: 497.578323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CN(CCC2C3=CC=C(C=C3)F)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CN(CCC2C3=CC=C(C=C3)F)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H28FNO5S/c1-20-7-13-25(14-8-20)35(31,32)34-19-23-17-29(27(30)33-18-21-5-3-2-4-6-21)16-15-26(23)22-9-11-24(28)12-10-22/h2-14,23,26H,15-19H2,1H3