5-[(4-fluorophenyl)methoxy]-4-oxidanylidene-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyran-2-carboxamide

Systemtic Name: 5-[(4-fluorophenyl)methoxy]-4-oxidanylidene-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyran-2-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-[(4-fluorophenyl)methoxy]-4-oxo-pyran-2-carboxamide CAS Name: 5-[(4-fluorophenyl)methoxy]-4-oxo-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-2-pyrancarboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-[(4-fluorophenyl)methoxy]-4-oxopyran-2-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-(4-fluorobenzyl)oxy-4-keto-pyran-2-carboxamide Formula: C25H26FN2O4+ MolecularWeight: 437.483343

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC(=O)C(=CO2)OCC3=CC=C(C=C3)F)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC(=O)C(=CO2)OCC3=CC=C(C=C3)F)CC4=CC=CC=C4

InChI

InChI=1S/C25H25FN2O4/c26-20-8-6-19(7-9-20)16-31-24-17-32-23(14-22(24)29)25(30)27-21-10-12-28(13-11-21)15-18-4-2-1-3-5-18/h1-9,14,17,21H,10-13,15-16H2,(H,27,30)/p+1