N,N-diethyl-1-[[2-(4-fluoranyl-3-methoxy-phenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N,N-diethyl-1-[[2-(4-fluoranyl-3-methoxy-phenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Openeye Name: N,N-diethyl-1-[[2-(4-fluoro-3-methoxy-phenyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-4-carboxamide CAS Name: N,N-diethyl-1-[[2-(4-fluoro-3-methoxyphenyl)-5-methyl-4-oxazolyl]methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N,N-diethyl-1-[[2-(4-fluoro-3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Traditional Name: N,N-diethyl-1-[[2-(4-fluoro-3-methoxy-phenyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Formula: C22H31FN3O3+ MolecularWeight: 404.498243

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CC[NH+](CC1)CC2=C(OC(=N2)C3=CC(=C(C=C3)F)OC)C

Isomeric SMILES

CCN(CC)C(=O)C1CC[NH+](CC1)CC2=C(OC(=N2)C3=CC(=C(C=C3)F)OC)C

InChI

InChI=1S/C22H30FN3O3/c1-5-26(6-2)22(27)16-9-11-25(12-10-16)14-19-15(3)29-21(24-19)17-7-8-18(23)20(13-17)28-4/h7-8,13,16H,5-6,9-12,14H2,1-4H3/p+1