2-methoxy-N-[2-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide

Systemtic Name: 2-methoxy-N-[2-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Openeye Name: 2-methoxy-N-[2-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide CAS Name: 2-methoxy-N-[2-[1-[(1-methyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]benzamide IUPAC Name: 2-methoxy-N-[2-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Traditional Name: 2-methoxy-N-[2-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Formula: C21H27N6O2+ MolecularWeight: 395.47808

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC=CC=C4OC

Isomeric SMILES

CN1C=C(C=N1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC=CC=C4OC

InChI

InChI=1S/C21H26N6O2/c1-25-14-16(13-23-25)15-26-11-8-17(9-12-26)27-20(7-10-22-27)24-21(28)18-5-3-4-6-19(18)29-2/h3-7,10,13-14,17H,8-9,11-12,15H2,1-2H3,(H,24,28)/p+1