2,6-bis(bromanyl)-3-ethyl-5-methylsulfanyl-benzoic acid

Systemtic Name: 2,6-bis(bromanyl)-3-ethyl-5-methylsulfanyl-benzoic acid Openeye Name: 2,6-dibromo-3-ethyl-5-methylsulfanyl-benzoic acid CAS Name: 2,6-dibromo-3-ethyl-5-(methylthio)benzoic acid IUPAC Name: 2,6-dibromo-3-ethyl-5-methylsulfanylbenzoic acid Traditional Name: 2,6-dibromo-3-ethyl-5-(methylthio)benzoic acid Formula: C10H10Br2O2S MolecularWeight: 354.0582

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1Br)C(=O)O)Br)SC

Isomeric SMILES

CCC1=CC(=C(C(=C1Br)C(=O)O)Br)SC

InChI

InChI=1S/C10H10Br2O2S/c1-3-5-4-6(15-2)9(12)7(8(5)11)10(13)14/h4H,3H2,1-2H3,(H,13,14)