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

Systemtic Name: (phenylmethyl) 3-[(4-methylphenyl)sulfonyloxymethyl]piperidine-1-carboxylate Openeye Name: benzyl 3-(p-tolylsulfonyloxymethyl)piperidine-1-carboxylate CAS Name: 3-[(4-methylphenyl)sulfonyloxymethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[(4-methylphenyl)sulfonyloxymethyl]piperidine-1-carboxylate Traditional Name: 3-(tosyloxymethyl)piperidine-1-carboxylic acid benzyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCCN(C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCCN(C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H25NO5S/c1-17-9-11-20(12-10-17)28(24,25)27-16-19-8-5-13-22(14-19)21(23)26-15-18-6-3-2-4-7-18/h2-4,6-7,9-12,19H,5,8,13-16H2,1H3