2-(1-oxidanylidenephthalazin-2-yl)-N-(3-piperidin-1-ium-1-ylpropyl)ethanamide

Systemtic Name: 2-(1-oxidanylidenephthalazin-2-yl)-N-(3-piperidin-1-ium-1-ylpropyl)ethanamide Openeye Name: 2-(1-oxophthalazin-2-yl)-N-(3-piperidin-1-ium-1-ylpropyl)acetamide CAS Name: 2-(1-oxo-2-phthalazinyl)-N-[3-(1-piperidin-1-iumyl)propyl]acetamide IUPAC Name: 2-(1-oxophthalazin-2-yl)-N-(3-piperidin-1-ium-1-ylpropyl)acetamide Traditional Name: 2-(1-ketophthalazin-2-yl)-N-(3-piperidin-1-ium-1-ylpropyl)acetamide Formula: C18H25N4O2+ MolecularWeight: 329.4167

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNC(=O)CN2C(=O)C3=CC=CC=C3C=N2

Isomeric SMILES

C1CC[NH+](CC1)CCCNC(=O)CN2C(=O)C3=CC=CC=C3C=N2

InChI

InChI=1S/C18H24N4O2/c23-17(19-9-6-12-21-10-4-1-5-11-21)14-22-18(24)16-8-3-2-7-15(16)13-20-22/h2-3,7-8,13H,1,4-6,9-12,14H2,(H,19,23)/p+1