(4-nitrophenyl)methyl 4-[(4-methylphenyl)sulfonyloxymethyl]piperidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 4-[(4-methylphenyl)sulfonyloxymethyl]piperidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-(p-tolylsulfonyloxymethyl)piperidine-1-carboxylate CAS Name: 4-[(4-methylphenyl)sulfonyloxymethyl]-1-piperidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-[(4-methylphenyl)sulfonyloxymethyl]piperidine-1-carboxylate Traditional Name: 4-(tosyloxymethyl)piperidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCN(CC2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCN(CC2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N2O7S/c1-16-2-8-20(9-3-16)31(27,28)30-15-18-10-12-22(13-11-18)21(24)29-14-17-4-6-19(7-5-17)23(25)26/h2-9,18H,10-15H2,1H3