2-(4-methylphthalazin-2-ium-2-yl)-1-(4-nitrophenyl)ethanone

Systemtic Name: 2-(4-methylphthalazin-2-ium-2-yl)-1-(4-nitrophenyl)ethanone Openeye Name: 2-(4-methylphthalazin-2-ium-2-yl)-1-(4-nitrophenyl)ethanone CAS Name: 2-(4-methyl-2-phthalazin-2-iumyl)-1-(4-nitrophenyl)ethanone IUPAC Name: 2-(4-methylphthalazin-2-ium-2-yl)-1-(4-nitrophenyl)ethanone Traditional Name: 2-(4-methylphthalazin-2-ium-2-yl)-1-(4-nitrophenyl)ethanone Formula: C17H14N3O3+ MolecularWeight: 308.31136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=N[N+](=CC2=CC=CC=C12)CC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=N[N+](=CC2=CC=CC=C12)CC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N3O3/c1-12-16-5-3-2-4-14(16)10-19(18-12)11-17(21)13-6-8-15(9-7-13)20(22)23/h2-10H,11H2,1H3/q+1