2-(3-bromanyl-4-methylsulfanyl-phenyl)ethanoic acid

Systemtic Name: 2-(3-bromanyl-4-methylsulfanyl-phenyl)ethanoic acid Openeye Name: 2-(3-bromo-4-methylsulfanyl-phenyl)acetic acid CAS Name: 2-[3-bromo-4-(methylthio)phenyl]acetic acid IUPAC Name: 2-(3-bromo-4-methylsulfanylphenyl)acetic acid Traditional Name: 2-[3-bromo-4-(methylthio)phenyl]acetic acid Formula: C9H9BrO2S MolecularWeight: 261.13556

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)CC(=O)O)Br

Isomeric SMILES

CSC1=C(C=C(C=C1)CC(=O)O)Br

InChI

InChI=1S/C9H9BrO2S/c1-13-8-3-2-6(4-7(8)10)5-9(11)12/h2-4H,5H2,1H3,(H,11,12)