2-(3-dodecylsulfanylpropanoylamino)-2-methyl-propane-1-sulfonic acid

Systemtic Name: 2-(3-dodecylsulfanylpropanoylamino)-2-methyl-propane-1-sulfonic acid Openeye Name: 2-(3-dodecylsulfanylpropanoylamino)-2-methyl-propane-1-sulfonic acid CAS Name: 2-[[3-(dodecylthio)-1-oxopropyl]amino]-2-methyl-1-propanesulfonic acid IUPAC Name: 2-(3-dodecylsulfanylpropanoylamino)-2-methylpropane-1-sulfonic acid Traditional Name: 2-[3-(laurylthio)propanoylamino]-2-methyl-propane-1-sulfonic acid Formula: C19H39NO4S2 MolecularWeight: 409.64726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCCC(=O)NC(C)(C)CS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCSCCC(=O)NC(C)(C)CS(=O)(=O)O

InChI

InChI=1S/C19H39NO4S2/c1-4-5-6-7-8-9-10-11-12-13-15-25-16-14-18(21)20-19(2,3)17-26(22,23)24/h4-17H2,1-3H3,(H,20,21)(H,22,23,24)