2-(3-sulfanylphenyl)butanoic acid

Systemtic Name: 2-(3-sulfanylphenyl)butanoic acid Openeye Name: 2-(3-sulfanylphenyl)butanoic acid CAS Name: 2-(3-mercaptophenyl)butanoic acid IUPAC Name: 2-(3-sulfanylphenyl)butanoic acid Traditional Name: 2-(3-mercaptophenyl)butyric acid Formula: C10H12O2S MolecularWeight: 196.26608

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)S)C(=O)O

Isomeric SMILES

CCC(C1=CC(=CC=C1)S)C(=O)O

InChI

InChI=1S/C10H12O2S/c1-2-9(10(11)12)7-4-3-5-8(13)6-7/h3-6,9,13H,2H2,1H3,(H,11,12)