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12-phenyl-11-(3-sulfanylidenepropyl)octadecane-1-sulfinate

12-phenyl-11-(3-sulfanylidenepropyl)octadecane-1-sulfinate

Systemtic Name:12-phenyl-11-(3-sulfanylidenepropyl)octadecane-1-sulfinate
Openeye Name:12-phenyl-11-(3-thioxopropyl)octadecane-1-sulfinate
CAS Name:12-phenyl-11-(3-sulfanylidenepropyl)-1-octadecanesulfinate
IUPAC Name:12-phenyl-11-(3-sulfanylidenepropyl)octadecane-1-sulfinate
Traditional Name:12-phenyl-11-(3-thioxopropyl)octadecane-1-sulfinate
Formula: C27H45O2S2-
MolecularWeight: 465.775
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C1=CC=CC=C1)C(CCCCCCCCCCS(=O)[O-])CCC=S


Isomeric SMILES

CCCCCCC(C1=CC=CC=C1)C(CCCCCCCCCCS(=O)[O-])CCC=S


InChI

InChI=1S/C27H46O2S2/c1-2-3-4-15-22-27(25-19-13-11-14-20-25)26(21-17-23-30)18-12-9-7-5-6-8-10-16-24-31(28)29/h11,13-14,19-20,23,26-27H,2-10,12,15-18,21-22,24H2,1H3,(H,28,29)/p-1


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