methyl 2-[1-[2,4-bis(fluoranyl)phenyl]carbonylpiperidin-4-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[1-[2,4-bis(fluoranyl)phenyl]carbonylpiperidin-4-yl]sulfonylbenzoate Openeye Name: methyl 2-[[1-(2,4-difluorobenzoyl)-4-piperidyl]sulfonyl]benzoate CAS Name: 2-[[1-[(2,4-difluorophenyl)-oxomethyl]-4-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[1-(2,4-difluorobenzoyl)piperidin-4-yl]sulfonylbenzoate Traditional Name: 2-[[1-(2,4-difluorobenzoyl)-4-piperidyl]sulfonyl]benzoic acid methyl ester Formula: C20H19F2NO5S MolecularWeight: 423.430366

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)C2CCN(CC2)C(=O)C3=C(C=C(C=C3)F)F

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)C2CCN(CC2)C(=O)C3=C(C=C(C=C3)F)F

InChI

InChI=1S/C20H19F2NO5S/c1-28-20(25)16-4-2-3-5-18(16)29(26,27)14-8-10-23(11-9-14)19(24)15-7-6-13(21)12-17(15)22/h2-7,12,14H,8-11H2,1H3