2-(4-methylsulfanylphenyl)sulfanyldecanoic acid

Systemtic Name: 2-(4-methylsulfanylphenyl)sulfanyldecanoic acid Openeye Name: 2-(4-methylsulfanylphenyl)sulfanyldecanoic acid CAS Name: 2-[[4-(methylthio)phenyl]thio]decanoic acid IUPAC Name: 2-(4-methylsulfanylphenyl)sulfanyldecanoic acid Traditional Name: 2-[[4-(methylthio)phenyl]thio]capric acid Formula: C17H26O2S2 MolecularWeight: 326.51714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(=O)O)SC1=CC=C(C=C1)SC

Isomeric SMILES

CCCCCCCCC(C(=O)O)SC1=CC=C(C=C1)SC

InChI

InChI=1S/C17H26O2S2/c1-3-4-5-6-7-8-9-16(17(18)19)21-15-12-10-14(20-2)11-13-15/h10-13,16H,3-9H2,1-2H3,(H,18,19)