N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[2-[(2S,6R)-2,6-dimethyl-4-morpholin-4-iumyl]-2-methylpropyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methylpropyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C19H27N4O3+ MolecularWeight: 359.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)C(C)(C)CNC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

C[C@@H]1C[NH+](C[C@@H](O1)C)C(C)(C)CNC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H26N4O3/c1-12-9-23(10-13(2)26-12)19(3,4)11-20-18(25)16-14-7-5-6-8-15(14)17(24)22-21-16/h5-8,12-13H,9-11H2,1-4H3,(H,20,25)(H,22,24)/p+1/t12-,13+