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

Systemtic Name: 1-(4-nitrophenyl)-2-pyrazin-1-ium-1-yl-ethanone Openeye Name: 1-(4-nitrophenyl)-2-pyrazin-1-ium-1-yl-ethanone CAS Name: 1-(4-nitrophenyl)-2-(1-pyrazin-1-iumyl)ethanone IUPAC Name: 1-(4-nitrophenyl)-2-pyrazin-1-ium-1-ylethanone Traditional Name: 1-(4-nitrophenyl)-2-pyrazin-1-ium-1-yl-ethanone Formula: C12H10N3O3+ MolecularWeight: 244.2261

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C[N+]2=CC=NC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)C[N+]2=CC=NC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H10N3O3/c16-12(9-14-7-5-13-6-8-14)10-1-3-11(4-2-10)15(17)18/h1-8H,9H2/q+1