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

Systemtic Name: 4-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 4-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-N-(4-pyridylmethyl)benzamide CAS Name: 4-[[1-[(1-methyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]oxy]-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 4-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-N-(pyridin-4-ylmethyl)benzamide Traditional Name: 4-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-N-(4-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=C(C=C3)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

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

InChI

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