4-(5-bromanylthiophen-2-yl)sulfonyloxy-3-chloranyl-5-methoxy-benzoic acid

Systemtic Name: 4-(5-bromanylthiophen-2-yl)sulfonyloxy-3-chloranyl-5-methoxy-benzoic acid Openeye Name: 4-[(5-bromo-2-thienyl)sulfonyloxy]-3-chloro-5-methoxy-benzoic acid CAS Name: 4-[(5-bromo-2-thiophenyl)sulfonyloxy]-3-chloro-5-methoxybenzoic acid IUPAC Name: 4-(5-bromothiophen-2-yl)sulfonyloxy-3-chloro-5-methoxybenzoic acid Traditional Name: 4-[(5-bromo-2-thienyl)sulfonyloxy]-3-chloro-5-methoxy-benzoic acid Formula: C12H8BrClO6S2 MolecularWeight: 427.67532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)O)Cl)OS(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)O)Cl)OS(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C12H8BrClO6S2/c1-19-8-5-6(12(15)16)4-7(14)11(8)20-22(17,18)10-3-2-9(13)21-10/h2-5H,1H3,(H,15,16)