dimethyl 2-[2,2-bis(fluoranylmethylsulfonyl)ethyl]-2-bromanyl-propanedioate

Systemtic Name: dimethyl 2-[2,2-bis(fluoranylmethylsulfonyl)ethyl]-2-bromanyl-propanedioate Openeye Name: dimethyl 2-[2,2-bis(fluoromethylsulfonyl)ethyl]-2-bromo-propanedioate CAS Name: 2-[2,2-bis(fluoromethylsulfonyl)ethyl]-2-bromopropanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[2,2-bis(fluoromethylsulfonyl)ethyl]-2-bromopropanedioate Traditional Name: 2-[2,2-bis(fluoromethylsulfonyl)ethyl]-2-bromo-malonic acid dimethyl ester Formula: C9H13BrF2O8S2 MolecularWeight: 431.225526

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(S(=O)(=O)CF)S(=O)(=O)CF)(C(=O)OC)Br

Isomeric SMILES

COC(=O)C(CC(S(=O)(=O)CF)S(=O)(=O)CF)(C(=O)OC)Br

InChI

InChI=1S/C9H13BrF2O8S2/c1-19-7(13)9(10,8(14)20-2)3-6(21(15,16)4-11)22(17,18)5-12/h6H,3-5H2,1-2H3