3-bromanyl-4-sulfanyl-benzoic acid

Systemtic Name: 3-bromanyl-4-sulfanyl-benzoic acid Openeye Name: 3-bromo-4-sulfanyl-benzoic acid CAS Name: 3-bromo-4-mercaptobenzoic acid IUPAC Name: 3-bromo-4-sulfanylbenzoic acid Traditional Name: 3-bromo-4-mercapto-benzoic acid Formula: C7H5BrO2S MolecularWeight: 233.0824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)Br)S

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)Br)S

InChI

InChI=1S/C7H5BrO2S/c8-5-3-4(7(9)10)1-2-6(5)11/h1-3,11H,(H,9,10)