methyl 1-[(3-nitrophenyl)methylsulfonyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(3-nitrophenyl)methylsulfonyl]piperidine-4-carboxylate Openeye Name: methyl 1-[(3-nitrophenyl)methylsulfonyl]piperidine-4-carboxylate CAS Name: 1-[(3-nitrophenyl)methylsulfonyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(3-nitrophenyl)methylsulfonyl]piperidine-4-carboxylate Traditional Name: 1-(3-nitrobenzyl)sulfonylisonipecotic acid methyl ester Formula: C14H18N2O6S MolecularWeight: 342.36752

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)S(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1CCN(CC1)S(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O6S/c1-22-14(17)12-5-7-15(8-6-12)23(20,21)10-11-3-2-4-13(9-11)16(18)19/h2-4,9,12H,5-8,10H2,1H3