N-methyl-1-[(1-oxidanylidenephthalazin-2-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-methyl-1-[(1-oxidanylidenephthalazin-2-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-methyl-1-[(1-oxophthalazin-2-yl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-methyl-1-[(1-oxo-2-phthalazinyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-methyl-1-[(1-oxophthalazin-2-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1-ketophthalazin-2-yl)methyl]-N-methyl-piperidin-1-ium-4-carboxamide Formula: C16H21N4O2+ MolecularWeight: 301.36354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O2/c1-17-15(21)12-6-8-19(9-7-12)11-20-16(22)14-5-3-2-4-13(14)10-18-20/h2-5,10,12H,6-9,11H2,1H3,(H,17,21)/p+1