2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)ethanamide

Systemtic Name: 2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)ethanamide Openeye Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)acetamide CAS Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]acetamide IUPAC Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)acetamide Traditional Name: 2-(1,4-diketo-3H-phthalazin-2-yl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)acetamide Formula: C18H25N4O4+ MolecularWeight: 361.4155

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)CN1C(=O)C2=CC=CC=C2C(=O)N1)[NH+]3CCOCC3

Isomeric SMILES

CC(C)(CNC(=O)CN1C(=O)C2=CC=CC=C2C(=O)N1)[NH+]3CCOCC3

InChI

InChI=1S/C18H24N4O4/c1-18(2,21-7-9-26-10-8-21)12-19-15(23)11-22-17(25)14-6-4-3-5-13(14)16(24)20-22/h3-6H,7-12H2,1-2H3,(H,19,23)(H,20,24)/p+1