19-[2-(4-oxidanyl-4-oxidanylidene-butyl)sulfanylphenyl]sulfanylnonadecanoic acid

Systemtic Name: 19-[2-(4-oxidanyl-4-oxidanylidene-butyl)sulfanylphenyl]sulfanylnonadecanoic acid Openeye Name: 19-[2-(4-hydroxy-4-oxo-butyl)sulfanylphenyl]sulfanylnonadecanoic acid CAS Name: 19-[[2-[(4-hydroxy-4-oxobutyl)thio]phenyl]thio]nonadecanoic acid IUPAC Name: 19-[2-(4-hydroxy-4-oxobutyl)sulfanylphenyl]sulfanylnonadecanoic acid Traditional Name: 19-[[2-[(4-hydroxy-4-keto-butyl)thio]phenyl]thio]nonadecanoic acid Formula: C29H48O4S2 MolecularWeight: 524.81902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H48O4S2/c30-28(31)22-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-18-24-34-26-20-16-17-21-27(26)35-25-19-23-29(32)33/h16-17,20-21H,1-15,18-19,22-25H2,(H,30,31)(H,32,33)