10-[2-(4-oxidanyl-4-oxidanylidene-butyl)sulfanylphenyl]sulfanyldecanoic acid

Systemtic Name: 10-[2-(4-oxidanyl-4-oxidanylidene-butyl)sulfanylphenyl]sulfanyldecanoic acid Openeye Name: 10-[2-(4-hydroxy-4-oxo-butyl)sulfanylphenyl]sulfanyldecanoic acid CAS Name: 10-[[2-[(4-hydroxy-4-oxobutyl)thio]phenyl]thio]decanoic acid IUPAC Name: 10-[2-(4-hydroxy-4-oxobutyl)sulfanylphenyl]sulfanyldecanoic acid Traditional Name: 10-[[2-[(4-hydroxy-4-keto-butyl)thio]phenyl]thio]capric acid Formula: C20H30O4S2 MolecularWeight: 398.5798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)SCCCCCCCCCC(=O)O)SCCCC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)SCCCCCCCCCC(=O)O)SCCCC(=O)O

InChI

InChI=1S/C20H30O4S2/c21-19(22)13-6-4-2-1-3-5-9-15-25-17-11-7-8-12-18(17)26-16-10-14-20(23)24/h7-8,11-12H,1-6,9-10,13-16H2,(H,21,22)(H,23,24)