N-ethyl-N-(2-pyrazol-1-ylethyl)-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-ethyl-N-(2-pyrazol-1-ylethyl)-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-ethyl-N-(2-pyrazol-1-ylethyl)-4-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-ethyl-N-[2-(1-pyrazolyl)ethyl]-4-[[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-ethyl-N-(2-pyrazol-1-ylethyl)-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-ethyl-N-(2-pyrazol-1-ylethyl)-4-[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:

CCN(CCN1C=CC=N1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=CC=CC=N4

Isomeric SMILES

CCN(CCN1C=CC=N1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=CC=CC=N4

InChI

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