4-[2-[5-nitro-4,6-bis(oxidanylidene)-1H-pyrimidin-2-yl]hydrazinyl]benzoic acid

Systemtic Name: 4-[2-[5-nitro-4,6-bis(oxidanylidene)-1H-pyrimidin-2-yl]hydrazinyl]benzoic acid Openeye Name: 4-[2-(5-nitro-4,6-dioxo-1H-pyrimidin-2-yl)hydrazino]benzoic acid CAS Name: 4-[(5-nitro-4,6-dioxo-1H-pyrimidin-2-yl)hydrazo]benzoic acid IUPAC Name: 4-[2-(5-nitro-4,6-dioxo-1H-pyrimidin-2-yl)hydrazinyl]benzoic acid Traditional Name: 4-[N'-(4,6-diketo-5-nitro-1H-pyrimidin-2-yl)hydrazino]benzoic acid Formula: C11H9N5O6 MolecularWeight: 307.21906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NNC2=NC(=O)C(C(=O)N2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NNC2=NC(=O)C(C(=O)N2)[N+](=O)[O-]

InChI

InChI=1S/C11H9N5O6/c17-8-7(16(21)22)9(18)13-11(12-8)15-14-6-3-1-5(2-4-6)10(19)20/h1-4,7,14H,(H,19,20)(H2,12,13,15,17,18)