2-butyl-N-(2-methylpropyl)-3-nitro-benzenesulfonamide

Systemtic Name: 2-butyl-N-(2-methylpropyl)-3-nitro-benzenesulfonamide Openeye Name: 2-butyl-N-isobutyl-3-nitro-benzenesulfonamide CAS Name: 2-butyl-N-(2-methylpropyl)-3-nitrobenzenesulfonamide IUPAC Name: 2-butyl-N-(2-methylpropyl)-3-nitrobenzenesulfonamide Traditional Name: 2-butyl-N-isobutyl-3-nitro-benzenesulfonamide Formula: C14H22N2O4S MolecularWeight: 314.40048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC=C1S(=O)(=O)NCC(C)C)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=C(C=CC=C1S(=O)(=O)NCC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H22N2O4S/c1-4-5-7-12-13(16(17)18)8-6-9-14(12)21(19,20)15-10-11(2)3/h6,8-9,11,15H,4-5,7,10H2,1-3H3