3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-N-(3-pyridylmethyl)benzamide CAS Name: 3-[[1-[(1-methyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]oxy]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-N-(3-pyridylmethyl)benzamide Formula: C23H28N5O2+ MolecularWeight: 406.50072

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C[NH+]2CCC(CC2)OC3=CC=CC(=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CN1C=C(C=N1)C[NH+]2CCC(CC2)OC3=CC=CC(=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C23H27N5O2/c1-27-16-19(15-26-27)17-28-10-7-21(8-11-28)30-22-6-2-5-20(12-22)23(29)25-14-18-4-3-9-24-13-18/h2-6,9,12-13,15-16,21H,7-8,10-11,14,17H2,1H3,(H,25,29)/p+1