3-methyl-N-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-(2-morpholin-4-ium-4-ylethyl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[2-(4-morpholin-4-iumyl)ethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-(2-morpholin-4-ium-4-ylethyl)-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-(2-morpholin-4-ium-4-ylethyl)phthalazine-1-carboxamide Formula: C16H21N4O3+ MolecularWeight: 317.36294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O3/c1-19-16(22)13-5-3-2-4-12(13)14(18-19)15(21)17-6-7-20-8-10-23-11-9-20/h2-5H,6-11H2,1H3,(H,17,21)/p+1