6-ethylsulfanyl-5-oxidanyl-8-phenyl-octanoic acid

Systemtic Name: 6-ethylsulfanyl-5-oxidanyl-8-phenyl-octanoic acid Openeye Name: 6-ethylsulfanyl-5-hydroxy-8-phenyl-octanoic acid CAS Name: 6-(ethylthio)-5-hydroxy-8-phenyloctanoic acid IUPAC Name: 6-ethylsulfanyl-5-hydroxy-8-phenyloctanoic acid Traditional Name: 6-(ethylthio)-5-hydroxy-8-phenyl-caprylic acid Formula: C16H24O3S MolecularWeight: 296.42496

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(CCC1=CC=CC=C1)C(CCCC(=O)O)O

Isomeric SMILES

CCSC(CCC1=CC=CC=C1)C(CCCC(=O)O)O

InChI

InChI=1S/C16H24O3S/c1-2-20-15(14(17)9-6-10-16(18)19)12-11-13-7-4-3-5-8-13/h3-5,7-8,14-15,17H,2,6,9-12H2,1H3,(H,18,19)