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

Systemtic Name: N-[3-(2-methylimidazol-1-yl)propyl]-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-[3-(2-methylimidazol-1-yl)propyl]-4-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-[3-(2-methyl-1-imidazolyl)propyl]-4-[[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-[3-(2-methylimidazol-1-yl)propyl]-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-[3-(2-methylimidazol-1-yl)propyl]-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:

CC1=NC=CN1CCCNC(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=CC=CC=N4

Isomeric SMILES

CC1=NC=CN1CCCNC(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=CC=CC=N4

InChI

InChI=1S/C25H31N5O2/c1-20-26-14-18-30(20)15-4-13-28-25(31)21-6-8-23(9-7-21)32-24-10-16-29(17-11-24)19-22-5-2-3-12-27-22/h2-3,5-9,12,14,18,24H,4,10-11,13,15-17,19H2,1H3,(H,28,31)/p+1