2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-6-phenyl-1,4-dihydropyridazin-3-one

Systemtic Name: 2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-6-phenyl-1,4-dihydropyridazin-3-one Openeye Name: 2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-6-phenyl-1,4-dihydropyridazin-3-one CAS Name: 2-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-6-phenyl-1,4-dihydropyridazin-3-one IUPAC Name: 2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]-6-phenyl-1,4-dihydropyridazin-3-one Traditional Name: 2-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-6-phenyl-1,4-dihydropyridazin-3-one Formula: C17H23N4O2+ MolecularWeight: 315.39012

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN2C(=O)CC=C(N2)C3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN2C(=O)CC=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C17H22N4O2/c1-19-9-11-20(12-10-19)17(23)13-21-16(22)8-7-15(18-21)14-5-3-2-4-6-14/h2-7,18H,8-13H2,1H3/p+1