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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NNC2=NC(=C(C(=O)N2)[N+](=O)[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/h1-4,14H,(H,19,20)(H3,12,13,15,17,18)