(4Z)-5-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methylidene]-2-phenyl-pyrazol-3-one

Systemtic Name: (4Z)-5-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methylidene]-2-phenyl-pyrazol-3-one Openeye Name: (4Z)-5-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methylene]-2-phenyl-pyrazol-3-one CAS Name: (4Z)-5-methyl-4-[(4-methyl-1-piperazin-4-iumyl)methylidene]-2-phenyl-3-pyrazolone IUPAC Name: (4Z)-5-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methylidene]-2-phenylpyrazol-3-one Traditional Name: (4Z)-5-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methylene]-2-phenyl-2-pyrazolin-3-one Formula: C16H21N4O+ MolecularWeight: 285.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CN2CC[NH+](CC2)C)C3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\N2CC[NH+](CC2)C)C3=CC=CC=C3

InChI

InChI=1S/C16H20N4O/c1-13-15(12-19-10-8-18(2)9-11-19)16(21)20(17-13)14-6-4-3-5-7-14/h3-7,12H,8-11H2,1-2H3/p+1/b15-12-