N-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]-3-(4-methyl-1-oxidanylidene-phthalazin-2-yl)benzamide

Systemtic Name: N-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]-3-(4-methyl-1-oxidanylidene-phthalazin-2-yl)benzamide Openeye Name: N-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]-3-(4-methyl-1-oxo-phthalazin-2-yl)benzamide CAS Name: N-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]-3-(4-methyl-1-oxo-2-phthalazinyl)benzamide IUPAC Name: N-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]-3-(4-methyl-1-oxophthalazin-2-yl)benzamide Traditional Name: 3-(1-keto-4-methyl-phthalazin-2-yl)-N-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]benzamide Formula: C22H22N5O2+ MolecularWeight: 388.44238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(N1)CN(C)C(=O)C2=CC(=CC=C2)N3C(=O)C4=CC=CC=C4C(=N3)C

Isomeric SMILES

CC1=C[NH+]=C(N1)CN(C)C(=O)C2=CC(=CC=C2)N3C(=O)C4=CC=CC=C4C(=N3)C

InChI

InChI=1S/C22H21N5O2/c1-14-12-23-20(24-14)13-26(3)21(28)16-7-6-8-17(11-16)27-22(29)19-10-5-4-9-18(19)15(2)25-27/h4-12H,13H2,1-3H3,(H,23,24)/p+1