sodium (4-nonylphenoxy)methanesulfonate

Systemtic Name: sodium (4-nonylphenoxy)methanesulfonate Openeye Name: sodium (4-nonylphenoxy)methanesulfonate CAS Name: sodium (4-nonylphenoxy)methanesulfonate IUPAC Name: sodium (4-nonylphenoxy)methanesulfonate Traditional Name: sodium (4-nonylphenoxy)methanesulfonate Formula: C16H25NaO4S MolecularWeight: 336.42207

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)OCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)OCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C16H26O4S.Na/c1-2-3-4-5-6-7-8-9-15-10-12-16(13-11-15)20-14-21(17,18)19;/h10-13H,2-9,14H2,1H3,(H,17,18,19);/q;+1/p-1