4-(4-methylpiperazin-4-ium-1-yl)carbonyl-5,6-diphenyl-pyridazin-3-olate

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)carbonyl-5,6-diphenyl-pyridazin-3-olate Openeye Name: 4-(4-methylpiperazin-4-ium-1-carbonyl)-5,6-diphenyl-pyridazin-3-olate CAS Name: 4-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-5,6-diphenyl-3-pyridazinolate IUPAC Name: 4-(4-methylpiperazin-4-ium-1-carbonyl)-5,6-diphenylpyridazin-3-olate Traditional Name: 4-(4-methylpiperazin-4-ium-1-carbonyl)-5,6-diphenyl-pyridazin-3-olate Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=C(C(=NN=C2[O-])C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=C(C(=NN=C2[O-])C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4O2/c1-25-12-14-26(15-13-25)22(28)19-18(16-8-4-2-5-9-16)20(23-24-21(19)27)17-10-6-3-7-11-17/h2-11H,12-15H2,1H3,(H,24,27)