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

Systemtic Name: [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-fluoro-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-fluoro-3-(1-piperidinylsulfonyl)benzoic acid [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-fluoro-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-piperidinosulfonyl-benzoic acid (3-o-phenetyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C23H24FN3O6S MolecularWeight: 489.516563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NOC(=N2)COC(=O)C3=CC(=C(C=C3)F)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCOC1=CC=CC=C1C2=NOC(=N2)COC(=O)C3=CC(=C(C=C3)F)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H24FN3O6S/c1-2-31-19-9-5-4-8-17(19)22-25-21(33-26-22)15-32-23(28)16-10-11-18(24)20(14-16)34(29,30)27-12-6-3-7-13-27/h4-5,8-11,14H,2-3,6-7,12-13,15H2,1H3