sodium 6-[(2-methoxyphenyl)amino]hexane-1-sulfonate

Systemtic Name: sodium 6-[(2-methoxyphenyl)amino]hexane-1-sulfonate Openeye Name: sodium 6-(2-methoxyanilino)hexane-1-sulfonate CAS Name: sodium 6-(2-methoxyanilino)-1-hexanesulfonate IUPAC Name: sodium 6-(2-methoxyanilino)hexane-1-sulfonate Traditional Name: sodium 6-(o-anisidino)hexane-1-sulfonate Formula: C13H20NNaO4S MolecularWeight: 309.35697

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NCCCCCCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

COC1=CC=CC=C1NCCCCCCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C13H21NO4S.Na/c1-18-13-9-5-4-8-12(13)14-10-6-2-3-7-11-19(15,16)17;/h4-5,8-9,14H,2-3,6-7,10-11H2,1H3,(H,15,16,17);/q;+1/p-1