3-nitro-4-oxidanyl-N-(1-oxidanylbutan-2-yl)benzenesulfonamide

Systemtic Name: 3-nitro-4-oxidanyl-N-(1-oxidanylbutan-2-yl)benzenesulfonamide Openeye Name: 4-hydroxy-N-[1-(hydroxymethyl)propyl]-3-nitro-benzenesulfonamide CAS Name: 4-hydroxy-N-(1-hydroxybutan-2-yl)-3-nitrobenzenesulfonamide IUPAC Name: 4-hydroxy-N-(1-hydroxybutan-2-yl)-3-nitrobenzenesulfonamide Traditional Name: 4-hydroxy-N-(1-methylolpropyl)-3-nitro-benzenesulfonamide Formula: C10H14N2O6S MolecularWeight: 290.29296

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NS(=O)(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]

Isomeric SMILES

CCC(CO)NS(=O)(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]

InChI

InChI=1S/C10H14N2O6S/c1-2-7(6-13)11-19(17,18)8-3-4-10(14)9(5-8)12(15)16/h3-5,7,11,13-14H,2,6H2,1H3