2-dodecyl-3-(2-oxidanylpropyl)benzenesulfonate

Systemtic Name: 2-dodecyl-3-(2-oxidanylpropyl)benzenesulfonate Openeye Name: 2-dodecyl-3-(2-hydroxypropyl)benzenesulfonate CAS Name: 2-dodecyl-3-(2-hydroxypropyl)benzenesulfonate IUPAC Name: 2-dodecyl-3-(2-hydroxypropyl)benzenesulfonate Traditional Name: 3-(2-hydroxypropyl)-2-lauryl-besylate Formula: C21H35O4S- MolecularWeight: 383.5652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(C=CC=C1S(=O)(=O)[O-])CC(C)O

Isomeric SMILES

CCCCCCCCCCCCC1=C(C=CC=C1S(=O)(=O)[O-])CC(C)O

InChI

InChI=1S/C21H36O4S/c1-3-4-5-6-7-8-9-10-11-12-15-20-19(17-18(2)22)14-13-16-21(20)26(23,24)25/h13-14,16,18,22H,3-12,15,17H2,1-2H3,(H,23,24,25)/p-1