3-nitro-4-(3-oxidanylpropylsulfonyl)benzenesulfonamide

Systemtic Name: 3-nitro-4-(3-oxidanylpropylsulfonyl)benzenesulfonamide Openeye Name: 4-(3-hydroxypropylsulfonyl)-3-nitro-benzenesulfonamide CAS Name: 4-(3-hydroxypropylsulfonyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-(3-hydroxypropylsulfonyl)-3-nitrobenzenesulfonamide Traditional Name: 4-(3-hydroxypropylsulfonyl)-3-nitro-benzenesulfonamide Formula: C9H12N2O7S2 MolecularWeight: 324.33078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)N)[N+](=O)[O-])S(=O)(=O)CCCO

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)N)[N+](=O)[O-])S(=O)(=O)CCCO

InChI

InChI=1S/C9H12N2O7S2/c10-20(17,18)7-2-3-9(8(6-7)11(13)14)19(15,16)5-1-4-12/h2-3,6,12H,1,4-5H2,(H2,10,17,18)