[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-fluoro-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-fluoro-3-(1-piperidinylsulfonyl)benzoic acid [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-fluoro-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-piperidinosulfonyl-benzoic acid [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C21H19ClFN3O5S MolecularWeight: 479.909063

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=NC(=NO3)C4=CC=C(C=C4)Cl)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=NC(=NO3)C4=CC=C(C=C4)Cl)F

InChI

InChI=1S/C21H19ClFN3O5S/c22-16-7-4-14(5-8-16)20-24-19(31-25-20)13-30-21(27)15-6-9-17(23)18(12-15)32(28,29)26-10-2-1-3-11-26/h4-9,12H,1-3,10-11,13H2