N-heptan-2-yl-2-nitro-benzenesulfonamide

Systemtic Name: N-heptan-2-yl-2-nitro-benzenesulfonamide Openeye Name: N-(1-methylhexyl)-2-nitro-benzenesulfonamide CAS Name: N-heptan-2-yl-2-nitrobenzenesulfonamide IUPAC Name: N-heptan-2-yl-2-nitrobenzenesulfonamide Traditional Name: N-(1-methylhexyl)-2-nitro-benzenesulfonamide Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O4S/c1-3-4-5-8-11(2)14-20(18,19)13-10-7-6-9-12(13)15(16)17/h6-7,9-11,14H,3-5,8H2,1-2H3