methyl 2-[bis(fluoranyl)-methylsulfonyl-methyl]-2-bromanyl-4-cyclohexyl-butanoate

Systemtic Name: methyl 2-[bis(fluoranyl)-methylsulfonyl-methyl]-2-bromanyl-4-cyclohexyl-butanoate Openeye Name: methyl 2-bromo-4-cyclohexyl-2-[difluoro(methylsulfonyl)methyl]butanoate CAS Name: 2-bromo-4-cyclohexyl-2-[difluoro(methylsulfonyl)methyl]butanoic acid methyl ester IUPAC Name: methyl 2-bromo-4-cyclohexyl-2-[difluoro(methylsulfonyl)methyl]butanoate Traditional Name: 2-bromo-4-cyclohexyl-2-[difluoro(mesyl)methyl]butyric acid methyl ester Formula: C13H21BrF2O4S MolecularWeight: 391.269246

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC1CCCCC1)(C(F)(F)S(=O)(=O)C)Br

Isomeric SMILES

COC(=O)C(CCC1CCCCC1)(C(F)(F)S(=O)(=O)C)Br

InChI

InChI=1S/C13H21BrF2O4S/c1-20-11(17)12(14,13(15,16)21(2,18)19)9-8-10-6-4-3-5-7-10/h10H,3-9H2,1-2H3