ethyl 5-[4,4-bis(fluoranyl)but-3-enylsulfonyl]-1-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[4,4-bis(fluoranyl)but-3-enylsulfonyl]-1-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-(4,4-difluorobut-3-enylsulfonyl)-1-methyl-pyrazole-4-carboxylate CAS Name: 5-(4,4-difluorobut-3-enylsulfonyl)-1-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4,4-difluorobut-3-enylsulfonyl)-1-methylpyrazole-4-carboxylate Traditional Name: 5-(4,4-difluorobut-3-enylsulfonyl)-1-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C11H14F2N2O4S MolecularWeight: 308.301666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C)S(=O)(=O)CCC=C(F)F

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C)S(=O)(=O)CCC=C(F)F

InChI

InChI=1S/C11H14F2N2O4S/c1-3-19-11(16)8-7-14-15(2)10(8)20(17,18)6-4-5-9(12)13/h5,7H,3-4,6H2,1-2H3