(3-methoxy-3-methyl-butyl) 2-azanylbenzenesulfonate

Systemtic Name: (3-methoxy-3-methyl-butyl) 2-azanylbenzenesulfonate Openeye Name: (3-methoxy-3-methyl-butyl) 2-aminobenzenesulfonate CAS Name: 2-aminobenzenesulfonic acid (3-methoxy-3-methylbutyl) ester IUPAC Name: (3-methoxy-3-methylbutyl) 2-aminobenzenesulfonate Traditional Name: 2-aminobenzenesulfonic acid (3-methoxy-3-methyl-butyl) ester Formula: C12H19NO4S MolecularWeight: 273.34856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCOS(=O)(=O)C1=CC=CC=C1N)OC

Isomeric SMILES

CC(C)(CCOS(=O)(=O)C1=CC=CC=C1N)OC

InChI

InChI=1S/C12H19NO4S/c1-12(2,16-3)8-9-17-18(14,15)11-7-5-4-6-10(11)13/h4-7H,8-9,13H2,1-3H3