methyl 1-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C16H19FN3O3+ MolecularWeight: 320.338763

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC[NH+](CC1)CC2=NC(=NO2)C3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)C1CC[NH+](CC1)CC2=NC(=NO2)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H18FN3O3/c1-22-16(21)12-6-8-20(9-7-12)10-14-18-15(19-23-14)11-2-4-13(17)5-3-11/h2-5,12H,6-10H2,1H3/p+1