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3-sulfanyloctadecanoic acid

3-sulfanyloctadecanoic acid

Systemtic Name:3-sulfanyloctadecanoic acid
Openeye Name:3-sulfanyloctadecanoic acid
CAS Name:3-mercaptooctadecanoic acid
IUPAC Name:3-sulfanyloctadecanoic acid
Traditional Name:3-mercaptostearic acid
Formula: C18H36O2S
MolecularWeight: 316.54224
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CC(=O)O)S


Isomeric SMILES

CCCCCCCCCCCCCCCC(CC(=O)O)S


InChI

InChI=1S/C18H36O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(21)16-18(19)20/h17,21H,2-16H2,1H3,(H,19,20)


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