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

Systemtic Name: 2-(2-azanylpyrimidin-1-ium-1-yl)-1-(3-nitrophenyl)ethanone Openeye Name: 2-(2-aminopyrimidin-1-ium-1-yl)-1-(3-nitrophenyl)ethanone CAS Name: 2-(2-amino-1-pyrimidin-1-iumyl)-1-(3-nitrophenyl)ethanone IUPAC Name: 2-(2-aminopyrimidin-1-ium-1-yl)-1-(3-nitrophenyl)ethanone Traditional Name: 2-(2-aminopyrimidin-1-ium-1-yl)-1-(3-nitrophenyl)ethanone Formula: C12H11N4O3+ MolecularWeight: 259.24074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C[N+]2=CC=CN=C2N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C[N+]2=CC=CN=C2N

InChI

InChI=1S/C12H10N4O3/c13-12-14-5-2-6-15(12)8-11(17)9-3-1-4-10(7-9)16(18)19/h1-7,13H,8H2/p+1