4-(2,3-dihydro-1H-inden-5-ylsulfanyl)butanoic acid

Systemtic Name: 4-(2,3-dihydro-1H-inden-5-ylsulfanyl)butanoic acid Openeye Name: 4-indan-5-ylsulfanylbutanoic acid CAS Name: 4-(2,3-dihydro-1H-inden-5-ylthio)butanoic acid IUPAC Name: 4-(2,3-dihydro-1H-inden-5-ylsulfanyl)butanoic acid Traditional Name: 4-(indan-5-ylthio)butyric acid Formula: C13H16O2S MolecularWeight: 236.32994

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)SCCCC(=O)O

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)SCCCC(=O)O

InChI

InChI=1S/C13H16O2S/c14-13(15)5-2-8-16-12-7-6-10-3-1-4-11(10)9-12/h6-7,9H,1-5,8H2,(H,14,15)