N-(6-methylheptan-2-yl)-2-nitro-benzenesulfonamide

Systemtic Name: N-(6-methylheptan-2-yl)-2-nitro-benzenesulfonamide Openeye Name: N-(1,5-dimethylhexyl)-2-nitro-benzenesulfonamide CAS Name: N-(6-methylheptan-2-yl)-2-nitrobenzenesulfonamide IUPAC Name: N-(6-methylheptan-2-yl)-2-nitrobenzenesulfonamide Traditional Name: N-(1,5-dimethylhexyl)-2-nitro-benzenesulfonamide Formula: C14H22N2O4S MolecularWeight: 314.40048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O4S/c1-11(2)7-6-8-12(3)15-21(19,20)14-10-5-4-9-13(14)16(17)18/h4-5,9-12,15H,6-8H2,1-3H3