2-(2,3-dihydro-1H-inden-5-ylsulfanyl)butanoic acid

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)butanoic acid Openeye Name: 2-indan-5-ylsulfanylbutanoic acid CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)butanoic acid IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)butanoic acid Traditional Name: 2-(indan-5-ylthio)butyric acid Formula: C13H16O2S MolecularWeight: 236.32994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)SC1=CC2=C(CCC2)C=C1

Isomeric SMILES

CCC(C(=O)O)SC1=CC2=C(CCC2)C=C1

InChI

InChI=1S/C13H16O2S/c1-2-12(13(14)15)16-11-7-6-9-4-3-5-10(9)8-11/h6-8,12H,2-5H2,1H3,(H,14,15)