2-[3-(sulfanylmethyl)phenyl]ethanoic acid

Systemtic Name: 2-[3-(sulfanylmethyl)phenyl]ethanoic acid Openeye Name: 2-[3-(sulfanylmethyl)phenyl]acetic acid CAS Name: 2-[3-(mercaptomethyl)phenyl]acetic acid IUPAC Name: 2-[3-(sulfanylmethyl)phenyl]acetic acid Traditional Name: 2-[3-(mercaptomethyl)phenyl]acetic acid Formula: C9H10O2S MolecularWeight: 182.2395

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CS)CC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CS)CC(=O)O

InChI

InChI=1S/C9H10O2S/c10-9(11)5-7-2-1-3-8(4-7)6-12/h1-4,12H,5-6H2,(H,10,11)