N-(3,3-dimethylbutan-2-yl)-3-nitro-benzenesulfonamide

Systemtic Name: N-(3,3-dimethylbutan-2-yl)-3-nitro-benzenesulfonamide Openeye Name: 3-nitro-N-(1,2,2-trimethylpropyl)benzenesulfonamide CAS Name: N-(3,3-dimethylbutan-2-yl)-3-nitrobenzenesulfonamide IUPAC Name: N-(3,3-dimethylbutan-2-yl)-3-nitrobenzenesulfonamide Traditional Name: 3-nitro-N-(1,2,2-trimethylpropyl)benzenesulfonamide Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O4S/c1-9(12(2,3)4)13-19(17,18)11-7-5-6-10(8-11)14(15)16/h5-9,13H,1-4H3