2-(2,2-dimethylpropyl)-3-(hydroxymethyl)benzenesulfonamide

Systemtic Name: 2-(2,2-dimethylpropyl)-3-(hydroxymethyl)benzenesulfonamide Openeye Name: 2-(2,2-dimethylpropyl)-3-(hydroxymethyl)benzenesulfonamide CAS Name: 2-(2,2-dimethylpropyl)-3-(hydroxymethyl)benzenesulfonamide IUPAC Name: 2-(2,2-dimethylpropyl)-3-(hydroxymethyl)benzenesulfonamide Traditional Name: 3-methylol-2-neopentyl-benzenesulfonamide Formula: C12H19NO3S MolecularWeight: 257.34916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=C(C=CC=C1S(=O)(=O)N)CO

Isomeric SMILES

CC(C)(C)CC1=C(C=CC=C1S(=O)(=O)N)CO

InChI

InChI=1S/C12H19NO3S/c1-12(2,3)7-10-9(8-14)5-4-6-11(10)17(13,15)16/h4-6,14H,7-8H2,1-3H3,(H2,13,15,16)