N-methyl-3-nitro-4-oxidanyl-N-piperidin-4-yl-benzenesulfonamide

Systemtic Name: N-methyl-3-nitro-4-oxidanyl-N-piperidin-4-yl-benzenesulfonamide Openeye Name: 4-hydroxy-N-methyl-3-nitro-N-(4-piperidyl)benzenesulfonamide CAS Name: 4-hydroxy-N-methyl-3-nitro-N-(4-piperidinyl)benzenesulfonamide IUPAC Name: 4-hydroxy-N-methyl-3-nitro-N-piperidin-4-ylbenzenesulfonamide Traditional Name: 4-hydroxy-N-methyl-3-nitro-N-(4-piperidyl)benzenesulfonamide Formula: C12H17N3O5S MolecularWeight: 315.34548

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCNCC1)S(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

CN(C1CCNCC1)S(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O5S/c1-14(9-4-6-13-7-5-9)21(19,20)10-2-3-12(16)11(8-10)15(17)18/h2-3,8-9,13,16H,4-7H2,1H3