N-(3-cyano-4-methyl-5-nitroso-6-oxidanyl-2-oxidanylidene-cyclohex-3-en-1-yl)benzenesulfonamide

Systemtic Name: N-(3-cyano-4-methyl-5-nitroso-6-oxidanyl-2-oxidanylidene-cyclohex-3-en-1-yl)benzenesulfonamide Openeye Name: N-(3-cyano-6-hydroxy-4-methyl-5-nitroso-2-oxo-cyclohex-3-en-1-yl)benzenesulfonamide CAS Name: N-(3-cyano-6-hydroxy-4-methyl-5-nitroso-2-oxo-1-cyclohex-3-enyl)benzenesulfonamide IUPAC Name: N-(3-cyano-6-hydroxy-4-methyl-5-nitroso-2-oxocyclohex-3-en-1-yl)benzenesulfonamide Traditional Name: N-(3-cyano-6-hydroxy-2-keto-4-methyl-5-nitroso-cyclohex-3-en-1-yl)benzenesulfonamide Formula: C14H13N3O5S MolecularWeight: 335.33512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(C(C1N=O)O)NS(=O)(=O)C2=CC=CC=C2)C#N

Isomeric SMILES

CC1=C(C(=O)C(C(C1N=O)O)NS(=O)(=O)C2=CC=CC=C2)C#N

InChI

InChI=1S/C14H13N3O5S/c1-8-10(7-15)13(18)12(14(19)11(8)16-20)17-23(21,22)9-5-3-2-4-6-9/h2-6,11-12,14,17,19H,1H3