6-(2-carboxyethylsulfanyl)-5-(2-hydroxyphenyl)hexanoic acid

Systemtic Name: 6-(2-carboxyethylsulfanyl)-5-(2-hydroxyphenyl)hexanoic acid Openeye Name: 6-(2-carboxyethylsulfanyl)-5-(2-hydroxyphenyl)hexanoic acid CAS Name: 6-(2-carboxyethylthio)-5-(2-hydroxyphenyl)hexanoic acid IUPAC Name: 6-(2-carboxyethylsulfanyl)-5-(2-hydroxyphenyl)hexanoic acid Traditional Name: 6-(2-carboxyethylthio)-5-(2-hydroxyphenyl)hexanoic acid Formula: C15H20O5S MolecularWeight: 312.3813

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(CCCC(=O)O)CSCCC(=O)O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(CCCC(=O)O)CSCCC(=O)O)O

InChI

InChI=1S/C15H20O5S/c16-13-6-2-1-5-12(13)11(4-3-7-14(17)18)10-21-9-8-15(19)20/h1-2,5-6,11,16H,3-4,7-10H2,(H,17,18)(H,19,20)