5-methoxy-6-(4-methylpiperazin-4-ium-1-yl)carbonyl-2-phenyl-pyridazin-3-one

Systemtic Name: 5-methoxy-6-(4-methylpiperazin-4-ium-1-yl)carbonyl-2-phenyl-pyridazin-3-one Openeye Name: 5-methoxy-6-(4-methylpiperazin-4-ium-1-carbonyl)-2-phenyl-pyridazin-3-one CAS Name: 5-methoxy-6-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-2-phenyl-3-pyridazinone IUPAC Name: 5-methoxy-6-(4-methylpiperazin-4-ium-1-carbonyl)-2-phenylpyridazin-3-one Traditional Name: 5-methoxy-6-(4-methylpiperazin-4-ium-1-carbonyl)-2-phenyl-pyridazin-3-one Formula: C17H21N4O3+ MolecularWeight: 329.37364

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=NN(C(=O)C=C2OC)C3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=NN(C(=O)C=C2OC)C3=CC=CC=C3

InChI

InChI=1S/C17H20N4O3/c1-19-8-10-20(11-9-19)17(23)16-14(24-2)12-15(22)21(18-16)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3/p+1