N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-[[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Formula: C25H32N5O2+ MolecularWeight: 434.55388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CCNC(=O)C2=CC=CC=C2OC3CC[NH+](CC3)CC4=CC=CC=N4

Isomeric SMILES

CC1=C(C(=NN1)C)CCNC(=O)C2=CC=CC=C2OC3CC[NH+](CC3)CC4=CC=CC=N4

InChI

InChI=1S/C25H31N5O2/c1-18-22(19(2)29-28-18)10-14-27-25(31)23-8-3-4-9-24(23)32-21-11-15-30(16-12-21)17-20-7-5-6-13-26-20/h3-9,13,21H,10-12,14-17H2,1-2H3,(H,27,31)(H,28,29)/p+1