N-methyl-3-nitro-4-oxidanyl-N-(thiolan-3-yl)benzenesulfonamide

Systemtic Name: N-methyl-3-nitro-4-oxidanyl-N-(thiolan-3-yl)benzenesulfonamide Openeye Name: 4-hydroxy-N-methyl-3-nitro-N-tetrahydrothiophen-3-yl-benzenesulfonamide CAS Name: 4-hydroxy-N-methyl-3-nitro-N-(3-thiolanyl)benzenesulfonamide IUPAC Name: 4-hydroxy-N-methyl-3-nitro-N-(thiolan-3-yl)benzenesulfonamide Traditional Name: 4-hydroxy-N-methyl-3-nitro-N-tetrahydrothiophen-3-yl-benzenesulfonamide Formula: C11H14N2O5S2 MolecularWeight: 318.36926

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCSC1)S(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

CN(C1CCSC1)S(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O5S2/c1-12(8-4-5-19-7-8)20(17,18)9-2-3-11(14)10(6-9)13(15)16/h2-3,6,8,14H,4-5,7H2,1H3