N-(4-methyl-4-oxidanyl-pentyl)-2-nitro-benzenesulfonamide

Systemtic Name: N-(4-methyl-4-oxidanyl-pentyl)-2-nitro-benzenesulfonamide Openeye Name: N-(4-hydroxy-4-methyl-pentyl)-2-nitro-benzenesulfonamide CAS Name: N-(4-hydroxy-4-methylpentyl)-2-nitrobenzenesulfonamide IUPAC Name: N-(4-hydroxy-4-methylpentyl)-2-nitrobenzenesulfonamide Traditional Name: N-(4-hydroxy-4-methyl-pentyl)-2-nitro-benzenesulfonamide Formula: C12H18N2O5S MolecularWeight: 302.34672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O5S/c1-12(2,15)8-5-9-13-20(18,19)11-7-4-3-6-10(11)14(16)17/h3-4,6-7,13,15H,5,8-9H2,1-2H3