7-[2-(4-oxidanyl-4-oxidanylidene-butyl)sulfanylphenyl]sulfanylheptanoic acid

Systemtic Name: 7-[2-(4-oxidanyl-4-oxidanylidene-butyl)sulfanylphenyl]sulfanylheptanoic acid Openeye Name: 7-[2-(4-hydroxy-4-oxo-butyl)sulfanylphenyl]sulfanylheptanoic acid CAS Name: 7-[[2-[(4-hydroxy-4-oxobutyl)thio]phenyl]thio]heptanoic acid IUPAC Name: 7-[2-(4-hydroxy-4-oxobutyl)sulfanylphenyl]sulfanylheptanoic acid Traditional Name: 7-[[2-[(4-hydroxy-4-keto-butyl)thio]phenyl]thio]enanthic acid Formula: C17H24O4S2 MolecularWeight: 356.50006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24O4S2/c18-16(19)10-3-1-2-6-12-22-14-8-4-5-9-15(14)23-13-7-11-17(20)21/h4-5,8-9H,1-3,6-7,10-13H2,(H,18,19)(H,20,21)