3-methyl-4-oxidanylidene-N-(1-propylpiperidin-1-ium-4-yl)phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-(1-propylpiperidin-1-ium-4-yl)phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-(1-propylpiperidin-1-ium-4-yl)phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-(1-propyl-4-piperidin-1-iumyl)-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-(1-propylpiperidin-1-ium-4-yl)phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-(1-propylpiperidin-1-ium-4-yl)phthalazine-1-carboxamide Formula: C18H25N4O2+ MolecularWeight: 329.4167

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N4O2/c1-3-10-22-11-8-13(9-12-22)19-17(23)16-14-6-4-5-7-15(14)18(24)21(2)20-16/h4-7,13H,3,8-12H2,1-2H3,(H,19,23)/p+1