N-(1,3-benzodioxol-5-yl)-3-nitro-4-oxidanyl-benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-nitro-4-oxidanyl-benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-hydroxy-3-nitro-benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-hydroxy-3-nitrobenzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-hydroxy-3-nitrobenzenesulfonamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-hydroxy-3-nitro-benzenesulfonamide Formula: C13H10N2O7S MolecularWeight: 338.2927

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C13H10N2O7S/c16-11-3-2-9(6-10(11)15(17)18)23(19,20)14-8-1-4-12-13(5-8)22-7-21-12/h1-6,14,16H,7H2