5-methylsulfonyloxy-2-[(4-nitrophenyl)methoxycarbonyl]piperidine-1-carboxylate

Systemtic Name: 5-methylsulfonyloxy-2-[(4-nitrophenyl)methoxycarbonyl]piperidine-1-carboxylate Openeye Name: 5-methylsulfonyloxy-2-[(4-nitrophenyl)methoxycarbonyl]piperidine-1-carboxylate CAS Name: 5-methylsulfonyloxy-2-[(4-nitrophenyl)methoxy-oxomethyl]-1-piperidinecarboxylate IUPAC Name: 5-methylsulfonyloxy-2-[(4-nitrophenyl)methoxycarbonyl]piperidine-1-carboxylate Traditional Name: 5-methylsulfonyloxy-2-(4-nitrobenzyl)oxycarbonyl-piperidine-1-carboxylate Formula: C15H17N2O9S- MolecularWeight: 401.36848

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CCC(N(C1)C(=O)[O-])C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)OC1CCC(N(C1)C(=O)[O-])C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O9S/c1-27(23,24)26-12-6-7-13(16(8-12)15(19)20)14(18)25-9-10-2-4-11(5-3-10)17(21)22/h2-5,12-13H,6-9H2,1H3,(H,19,20)/p-1