2-bromanyl-2-methoxycarbonyl-4,4-bis(trifluoromethylsulfonyl)butanoic acid

Systemtic Name: 2-bromanyl-2-methoxycarbonyl-4,4-bis(trifluoromethylsulfonyl)butanoic acid Openeye Name: 2-bromo-2-methoxycarbonyl-4,4-bis(trifluoromethylsulfonyl)butanoic acid CAS Name: 2-bromo-2-methoxycarbonyl-4,4-bis(trifluoromethylsulfonyl)butanoic acid IUPAC Name: 2-bromo-2-methoxycarbonyl-4,4-bis(trifluoromethylsulfonyl)butanoic acid Traditional Name: 2-bromo-2-carbomethoxy-4,4-ditriflyl-butyric acid Formula: C8H7BrF6O8S2 MolecularWeight: 489.160799

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F)(C(=O)O)Br

Isomeric SMILES

COC(=O)C(CC(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F)(C(=O)O)Br

InChI

InChI=1S/C8H7BrF6O8S2/c1-23-5(18)6(9,4(16)17)2-3(24(19,20)7(10,11)12)25(21,22)8(13,14)15/h3H,2H2,1H3,(H,16,17)