2-[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-(2,4-dioxo-1H-pyrimidin-5-yl)-5-nitro-isoindoline-1,3-dione CAS Name: 2-(2,4-dioxo-1H-pyrimidin-5-yl)-5-nitroisoindole-1,3-dione IUPAC Name: 2-(2,4-dioxo-1H-pyrimidin-5-yl)-5-nitroisoindole-1,3-dione Traditional Name: 2-(2,4-diketo-1H-pyrimidin-5-yl)-5-nitro-isoindoline-1,3-quinone Formula: C12H6N4O6 MolecularWeight: 302.19924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)C3=CNC(=O)NC3=O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)C3=CNC(=O)NC3=O

InChI

InChI=1S/C12H6N4O6/c17-9-8(4-13-12(20)14-9)15-10(18)6-2-1-5(16(21)22)3-7(6)11(15)19/h1-4H,(H2,13,14,17,20)