4-methyl-N-(2-methylbutan-2-yl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-methyl-N-(2-methylbutan-2-yl)-3-nitro-benzenesulfonamide Openeye Name: N-(1,1-dimethylpropyl)-4-methyl-3-nitro-benzenesulfonamide CAS Name: 4-methyl-N-(2-methylbutan-2-yl)-3-nitrobenzenesulfonamide IUPAC Name: 4-methyl-N-(2-methylbutan-2-yl)-3-nitrobenzenesulfonamide Traditional Name: N-tert-amyl-4-methyl-3-nitro-benzenesulfonamide Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O4S/c1-5-12(3,4)13-19(17,18)10-7-6-9(2)11(8-10)14(15)16/h6-8,13H,5H2,1-4H3