methyl 1-[3,5-bis(fluoranyl)phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[3,5-bis(fluoranyl)phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: methyl 1-(3,5-difluorophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(3,5-difluorophenyl)sulfonyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3,5-difluorophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(3,5-difluorophenyl)sulfonylisonipecotic acid methyl ester Formula: C13H15F2NO4S MolecularWeight: 319.324306

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2)F)F

Isomeric SMILES

COC(=O)C1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2)F)F

InChI

InChI=1S/C13H15F2NO4S/c1-20-13(17)9-2-4-16(5-3-9)21(18,19)12-7-10(14)6-11(15)8-12/h6-9H,2-5H2,1H3