6-oxidanylidene-1-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyridazin-3-olate

Systemtic Name: 6-oxidanylidene-1-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyridazin-3-olate Openeye Name: 6-oxo-1-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyridazin-3-olate CAS Name: 6-oxo-1-[(4-phenyl-1-piperazin-1-iumyl)methyl]-3-pyridazinolate IUPAC Name: 6-oxo-1-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyridazin-3-olate Traditional Name: 6-keto-1-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyridazin-3-olate Formula: C15H18N4O2 MolecularWeight: 286.32902

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C(=O)C=CC(=N2)[O-])C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CN2C(=O)C=CC(=N2)[O-])C3=CC=CC=C3

InChI

InChI=1S/C15H18N4O2/c20-14-6-7-15(21)19(16-14)12-17-8-10-18(11-9-17)13-4-2-1-3-5-13/h1-7H,8-12H2,(H,16,20)