2-(3-methoxyphenyl)-2-sulfanyl-ethanoic acid

Systemtic Name: 2-(3-methoxyphenyl)-2-sulfanyl-ethanoic acid Openeye Name: 2-(3-methoxyphenyl)-2-sulfanyl-acetic acid CAS Name: 2-mercapto-2-(3-methoxyphenyl)acetic acid IUPAC Name: 2-(3-methoxyphenyl)-2-sulfanylacetic acid Traditional Name: 2-mercapto-2-(3-methoxyphenyl)acetic acid Formula: C9H10O3S MolecularWeight: 198.2389

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C(=O)O)S

Isomeric SMILES

COC1=CC=CC(=C1)C(C(=O)O)S

InChI

InChI=1S/C9H10O3S/c1-12-7-4-2-3-6(5-7)8(13)9(10)11/h2-5,8,13H,1H3,(H,10,11)