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

Systemtic Name: N-(3-pyrazol-1-ylpropyl)-2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-(3-pyrazol-1-ylpropyl)-2-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-[3-(1-pyrazolyl)propyl]-2-[[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-(3-pyrazol-1-ylpropyl)-2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-(3-pyrazol-1-ylpropyl)-2-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Formula: C24H30N5O2+ MolecularWeight: 420.5273

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1OC2=CC=CC=C2C(=O)NCCCN3C=CC=N3)CC4=CC=CC=N4

Isomeric SMILES

C1C[NH+](CCC1OC2=CC=CC=C2C(=O)NCCCN3C=CC=N3)CC4=CC=CC=N4

InChI

InChI=1S/C24H29N5O2/c30-24(26-13-5-15-29-16-6-14-27-29)22-8-1-2-9-23(22)31-21-10-17-28(18-11-21)19-20-7-3-4-12-25-20/h1-4,6-9,12,14,16,21H,5,10-11,13,15,17-19H2,(H,26,30)/p+1