2,3-dimethyl-N-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-5-nitro-benzenesulfonamide

Systemtic Name: 2,3-dimethyl-N-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-5-nitro-benzenesulfonamide Openeye Name: 2,3-dimethyl-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-5-nitro-benzenesulfonamide CAS Name: 2,3-dimethyl-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-5-nitrobenzenesulfonamide IUPAC Name: 2,3-dimethyl-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-5-nitrobenzenesulfonamide Traditional Name: N-(3-keto-2-methyl-4H-1,4-benzoxazin-6-yl)-2,3-dimethyl-5-nitro-benzenesulfonamide Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=C(C(=CC(=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1C(=O)NC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=C(C(=CC(=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C17H17N3O6S/c1-9-6-13(20(22)23)8-16(10(9)2)27(24,25)19-12-4-5-15-14(7-12)18-17(21)11(3)26-15/h4-8,11,19H,1-3H3,(H,18,21)