2-piperidin-1-ium-1-ylpyridazino[6,1-b]quinazolin-10-one chloride

Systemtic Name: 2-piperidin-1-ium-1-ylpyridazino[6,1-b]quinazolin-10-one chloride Openeye Name: 2-piperidin-1-ium-1-ylpyridazino[6,1-b]quinazolin-10-one chloride CAS Name: 2-(1-piperidin-1-iumyl)-10-pyridazino[6,1-b]quinazolinone chloride IUPAC Name: 2-piperidin-1-ium-1-ylpyridazino[6,1-b]quinazolin-10-one chloride Traditional Name: 2-piperidin-1-ium-1-ylpyridazino[6,1-b]quinazolin-10-one chloride Formula: C16H17ClN4O MolecularWeight: 316.78538

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2=NN3C(=NC4=CC=CC=C4C3=O)C=C2.[Cl-]

Isomeric SMILES

C1CC[NH+](CC1)C2=NN3C(=NC4=CC=CC=C4C3=O)C=C2.[Cl-]

InChI

InChI=1S/C16H16N4O.ClH/c21-16-12-6-2-3-7-13(12)17-14-8-9-15(18-20(14)16)19-10-4-1-5-11-19;/h2-3,6-9H,1,4-5,10-11H2;1H