ethyl 1-[1-[bis(fluoranyl)methyl]-3-methyl-pyrazol-4-yl]sulfonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-[bis(fluoranyl)methyl]-3-methyl-pyrazol-4-yl]sulfonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-(difluoromethyl)-3-methyl-pyrazol-4-yl]sulfonylpiperidine-3-carboxylate CAS Name: 1-[[1-(difluoromethyl)-3-methyl-4-pyrazolyl]sulfonyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(difluoromethyl)-3-methylpyrazol-4-yl]sulfonylpiperidine-3-carboxylate Traditional Name: 1-[1-(difluoromethyl)-3-methyl-pyrazol-4-yl]sulfonylnipecotic acid ethyl ester Formula: C13H19F2N3O4S MolecularWeight: 351.369466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CN(N=C2C)C(F)F

Isomeric SMILES

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CN(N=C2C)C(F)F

InChI

InChI=1S/C13H19F2N3O4S/c1-3-22-12(19)10-5-4-6-17(7-10)23(20,21)11-8-18(13(14)15)16-9(11)2/h8,10,13H,3-7H2,1-2H3