4-chloranyl-N-(3-methyl-1-oxidanyl-hexan-2-yl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(3-methyl-1-oxidanyl-hexan-2-yl)benzenesulfonamide Openeye Name: 4-chloro-N-[1-(hydroxymethyl)-2-methyl-pentyl]benzenesulfonamide CAS Name: 4-chloro-N-(1-hydroxy-3-methylhexan-2-yl)benzenesulfonamide IUPAC Name: 4-chloro-N-(1-hydroxy-3-methylhexan-2-yl)benzenesulfonamide Traditional Name: 4-chloro-N-(2-methyl-1-methylol-pentyl)benzenesulfonamide Formula: C13H20ClNO3S MolecularWeight: 305.8208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(CO)NS(=O)(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CCCC(C)C(CO)NS(=O)(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H20ClNO3S/c1-3-4-10(2)13(9-16)15-19(17,18)12-7-5-11(14)6-8-12/h5-8,10,13,15-16H,3-4,9H2,1-2H3