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

Systemtic Name: (phenylmethyl) 4-[3-(4-methylphenyl)sulfonyloxypropyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[3-(p-tolylsulfonyloxy)propyl]piperidine-1-carboxylate CAS Name: 4-[3-(4-methylphenyl)sulfonyloxypropyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[3-(4-methylphenyl)sulfonyloxypropyl]piperidine-1-carboxylate Traditional Name: 4-(3-tosyloxypropyl)piperidine-1-carboxylic acid benzyl ester Formula: C23H29NO5S MolecularWeight: 431.54506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2CCN(CC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2CCN(CC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H29NO5S/c1-19-9-11-22(12-10-19)30(26,27)29-17-5-8-20-13-15-24(16-14-20)23(25)28-18-21-6-3-2-4-7-21/h2-4,6-7,9-12,20H,5,8,13-18H2,1H3