2-bromanyl-2-(4-ethanethioylphenyl)ethanoic acid

Systemtic Name: 2-bromanyl-2-(4-ethanethioylphenyl)ethanoic acid Openeye Name: 2-bromo-2-(4-ethanethioylphenyl)acetic acid CAS Name: 2-bromo-2-[4-(1-sulfanylideneethyl)phenyl]acetic acid IUPAC Name: 2-bromo-2-(4-ethanethioylphenyl)acetic acid Traditional Name: 2-bromo-2-(4-thioacetylphenyl)acetic acid Formula: C10H9BrO2S MolecularWeight: 273.14626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9BrO2S/c1-6(14)7-2-4-8(5-3-7)9(11)10(12)13/h2-5,9H,1H3,(H,12,13)