N-(2-methoxy-5-nitro-phenyl)-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(2-methoxy-5-nitro-phenyl)piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(2-methoxy-5-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(2-methoxy-5-nitrophenyl)piperidine-4-carboxamide Traditional Name: 1-besyl-N-(2-methoxy-5-nitro-phenyl)isonipecotamide Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O6S/c1-28-18-8-7-15(22(24)25)13-17(18)20-19(23)14-9-11-21(12-10-14)29(26,27)16-5-3-2-4-6-16/h2-8,13-14H,9-12H2,1H3,(H,20,23)