1-(3-nitrophenyl)-2-pyrazin-1-ium-1-yl-ethanone

Systemtic Name: 1-(3-nitrophenyl)-2-pyrazin-1-ium-1-yl-ethanone Openeye Name: 1-(3-nitrophenyl)-2-pyrazin-1-ium-1-yl-ethanone CAS Name: 1-(3-nitrophenyl)-2-(1-pyrazin-1-iumyl)ethanone IUPAC Name: 1-(3-nitrophenyl)-2-pyrazin-1-ium-1-ylethanone Traditional Name: 1-(3-nitrophenyl)-2-pyrazin-1-ium-1-yl-ethanone Formula: C12H10N3O3+ MolecularWeight: 244.2261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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