5-[4-[1-(furan-2-ylmethyl)piperidin-4-yl]piperazin-4-ium-1-yl]-2-methyl-pyridazin-3-one

Systemtic Name: 5-[4-[1-(furan-2-ylmethyl)piperidin-4-yl]piperazin-4-ium-1-yl]-2-methyl-pyridazin-3-one Openeye Name: 5-[4-[1-(2-furylmethyl)-4-piperidyl]piperazin-4-ium-1-yl]-2-methyl-pyridazin-3-one CAS Name: 5-[4-[1-(2-furanylmethyl)-4-piperidinyl]-1-piperazin-4-iumyl]-2-methyl-3-pyridazinone IUPAC Name: 5-[4-[1-(furan-2-ylmethyl)piperidin-4-yl]piperazin-4-ium-1-yl]-2-methylpyridazin-3-one Traditional Name: 5-[4-[1-(2-furfuryl)-4-piperidyl]piperazin-4-ium-1-yl]-2-methyl-pyridazin-3-one Formula: C19H28N5O2+ MolecularWeight: 358.45792

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(C=N1)N2CC[NH+](CC2)C3CCN(CC3)CC4=CC=CO4

Isomeric SMILES

CN1C(=O)C=C(C=N1)N2CC[NH+](CC2)C3CCN(CC3)CC4=CC=CO4

InChI

InChI=1S/C19H27N5O2/c1-21-19(25)13-17(14-20-21)24-10-8-23(9-11-24)16-4-6-22(7-5-16)15-18-3-2-12-26-18/h2-3,12-14,16H,4-11,15H2,1H3/p+1