potassium 3-[2-(3-cyano-3-dodecylsulfonyl-prop-2-enylidene)-1,3-thiazolidin-3-yl]propane-1-sulfonate

Systemtic Name: potassium 3-[2-(3-cyano-3-dodecylsulfonyl-prop-2-enylidene)-1,3-thiazolidin-3-yl]propane-1-sulfonate Openeye Name: potassium 3-[2-(3-cyano-3-dodecylsulfonyl-prop-2-enylidene)thiazolidin-3-yl]propane-1-sulfonate CAS Name: potassium 3-[2-(3-cyano-3-dodecylsulfonylprop-2-enylidene)-3-thiazolidinyl]-1-propanesulfonate IUPAC Name: potassium 3-[2-(3-cyano-3-dodecylsulfonylprop-2-enylidene)-1,3-thiazolidin-3-yl]propane-1-sulfonate Traditional Name: potassium 3-[2-(3-cyano-3-laurylsulfonyl-prop-2-enylidene)thiazolidin-3-yl]propane-1-sulfonate Formula: C22H37KN2O5S3 MolecularWeight: 544.83288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCS(=O)(=O)C(=CC=C1N(CCS1)CCCS(=O)(=O)[O-])C#N.[K+]

Isomeric SMILES

CCCCCCCCCCCCS(=O)(=O)C(=CC=C1N(CCS1)CCCS(=O)(=O)[O-])C#N.[K+]

InChI

InChI=1S/C22H38N2O5S3.K/c1-2-3-4-5-6-7-8-9-10-11-18-31(25,26)21(20-23)13-14-22-24(16-17-30-22)15-12-19-32(27,28)29;/h13-14H,2-12,15-19H2,1H3,(H,27,28,29);/q;+1/p-1