N-(2-propan-2-yloxyethyl)-2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-(2-propan-2-yloxyethyl)-2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-(2-isopropoxyethyl)-2-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-(2-propan-2-yloxyethyl)-2-[[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-(2-propan-2-yloxyethyl)-2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-(2-isopropoxyethyl)-2-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Formula: C23H32N3O3+ MolecularWeight: 398.51848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCNC(=O)C1=CC=CC=C1OC2CC[NH+](CC2)CC3=CC=CC=N3

Isomeric SMILES

CC(C)OCCNC(=O)C1=CC=CC=C1OC2CC[NH+](CC2)CC3=CC=CC=N3

InChI

InChI=1S/C23H31N3O3/c1-18(2)28-16-13-25-23(27)21-8-3-4-9-22(21)29-20-10-14-26(15-11-20)17-19-7-5-6-12-24-19/h3-9,12,18,20H,10-11,13-17H2,1-2H3,(H,25,27)/p+1