N-(4-methylpyridin-2-yl)-3-nitro-4-oxidanyl-benzenesulfonamide

Systemtic Name: N-(4-methylpyridin-2-yl)-3-nitro-4-oxidanyl-benzenesulfonamide Openeye Name: 4-hydroxy-N-(4-methyl-2-pyridyl)-3-nitro-benzenesulfonamide CAS Name: 4-hydroxy-N-(4-methyl-2-pyridinyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-hydroxy-N-(4-methylpyridin-2-yl)-3-nitrobenzenesulfonamide Traditional Name: 4-hydroxy-N-(4-methyl-2-pyridyl)-3-nitro-benzenesulfonamide Formula: C12H11N3O5S MolecularWeight: 309.29784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC=C1)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O5S/c1-8-4-5-13-12(6-8)14-21(19,20)9-2-3-11(16)10(7-9)15(17)18/h2-7,16H,1H3,(H,13,14)