sodium (E)-3-oxidanylideneicos-11-ene-1-sulfonate

Systemtic Name: sodium (E)-3-oxidanylideneicos-11-ene-1-sulfonate Openeye Name: sodium (E)-3-oxoicos-11-ene-1-sulfonate CAS Name: sodium (E)-3-oxo-11-eicosene-1-sulfonate IUPAC Name: sodium (E)-3-oxoicos-11-ene-1-sulfonate Traditional Name: sodium (E)-3-ketoeicos-11-ene-1-sulfonate Formula: C20H37NaO4S MolecularWeight: 396.56015

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)CCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)CCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C20H38O4S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(21)18-19-25(22,23)24;/h9-10H,2-8,11-19H2,1H3,(H,22,23,24);/q;+1/p-1/b10-9+;