methyl 4-bromanyl-2-sulfanyl-benzoate

Systemtic Name: methyl 4-bromanyl-2-sulfanyl-benzoate Openeye Name: methyl 4-bromo-2-sulfanyl-benzoate CAS Name: 4-bromo-2-mercaptobenzoic acid methyl ester IUPAC Name: methyl 4-bromo-2-sulfanylbenzoate Traditional Name: 4-bromo-2-mercapto-benzoic acid methyl ester Formula: C8H7BrO2S MolecularWeight: 247.10898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H7BrO2S/c1-11-8(10)6-3-2-5(9)4-7(6)12/h2-4,12H,1H3