4-[1-(1,2-oxazol-3-ylmethyl)piperidin-1-ium-4-yl]oxy-N-(pyridin-4-ylmethyl)benzamide

Systemtic Name: 4-[1-(1,2-oxazol-3-ylmethyl)piperidin-1-ium-4-yl]oxy-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 4-[1-(isoxazol-3-ylmethyl)piperidin-1-ium-4-yl]oxy-N-(4-pyridylmethyl)benzamide CAS Name: 4-[[1-(3-isoxazolylmethyl)-4-piperidin-1-iumyl]oxy]-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 4-[1-(1,2-oxazol-3-ylmethyl)piperidin-1-ium-4-yl]oxy-N-(pyridin-4-ylmethyl)benzamide Traditional Name: 4-[1-(isoxazol-3-ylmethyl)piperidin-1-ium-4-yl]oxy-N-(4-pyridylmethyl)benzamide Formula: C22H25N4O3+ MolecularWeight: 393.4589

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1OC2=CC=C(C=C2)C(=O)NCC3=CC=NC=C3)CC4=NOC=C4

Isomeric SMILES

C1C[NH+](CCC1OC2=CC=C(C=C2)C(=O)NCC3=CC=NC=C3)CC4=NOC=C4

InChI

InChI=1S/C22H24N4O3/c27-22(24-15-17-5-10-23-11-6-17)18-1-3-20(4-2-18)29-21-7-12-26(13-8-21)16-19-9-14-28-25-19/h1-6,9-11,14,21H,7-8,12-13,15-16H2,(H,24,27)/p+1