2-but-2-ynyl-5-(4-methylpiperazin-4-ium-1-yl)pyridazin-3-one

Systemtic Name: 2-but-2-ynyl-5-(4-methylpiperazin-4-ium-1-yl)pyridazin-3-one Openeye Name: 2-but-2-ynyl-5-(4-methylpiperazin-4-ium-1-yl)pyridazin-3-one CAS Name: 2-but-2-ynyl-5-(4-methyl-1-piperazin-4-iumyl)-3-pyridazinone IUPAC Name: 2-but-2-ynyl-5-(4-methylpiperazin-4-ium-1-yl)pyridazin-3-one Traditional Name: 2-but-2-ynyl-5-(4-methylpiperazin-4-ium-1-yl)pyridazin-3-one Formula: C13H19N4O+ MolecularWeight: 247.31616

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C(=O)C=C(C=N1)N2CC[NH+](CC2)C

Isomeric SMILES

CC#CCN1C(=O)C=C(C=N1)N2CC[NH+](CC2)C

InChI

InChI=1S/C13H18N4O/c1-3-4-5-17-13(18)10-12(11-14-17)16-8-6-15(2)7-9-16/h10-11H,5-9H2,1-2H3/p+1