2-methyl-4-(4-methylpiperazin-4-ium-1-yl)carbonyl-phthalazin-1-one

Systemtic Name: 2-methyl-4-(4-methylpiperazin-4-ium-1-yl)carbonyl-phthalazin-1-one Openeye Name: 2-methyl-4-(4-methylpiperazin-4-ium-1-carbonyl)phthalazin-1-one CAS Name: 2-methyl-4-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-1-phthalazinone IUPAC Name: 2-methyl-4-(4-methylpiperazin-4-ium-1-carbonyl)phthalazin-1-one Traditional Name: 2-methyl-4-(4-methylpiperazin-4-ium-1-carbonyl)phthalazin-1-one Formula: C15H19N4O2+ MolecularWeight: 287.33696

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C15H18N4O2/c1-17-7-9-19(10-8-17)15(21)13-11-5-3-4-6-12(11)14(20)18(2)16-13/h3-6H,7-10H2,1-2H3/p+1