2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-N-(4-methylpiperazin-4-ium-1-yl)ethanamide

Systemtic Name: 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-N-(4-methylpiperazin-4-ium-1-yl)ethanamide Openeye Name: 2-(3-methyl-4-oxo-phthalazin-1-yl)-N-(4-methylpiperazin-4-ium-1-yl)acetamide CAS Name: 2-(3-methyl-4-oxo-1-phthalazinyl)-N-(4-methyl-1-piperazin-4-iumyl)acetamide IUPAC Name: 2-(3-methyl-4-oxophthalazin-1-yl)-N-(4-methylpiperazin-4-ium-1-yl)acetamide Traditional Name: 2-(4-keto-3-methyl-phthalazin-1-yl)-N-(4-methylpiperazin-4-ium-1-yl)acetamide Formula: C16H22N5O2+ MolecularWeight: 316.37818

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C16H21N5O2/c1-19-7-9-21(10-8-19)18-15(22)11-14-12-5-3-4-6-13(12)16(23)20(2)17-14/h3-6H,7-11H2,1-2H3,(H,18,22)/p+1