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

Systemtic Name: 4-[[5-nitro-4,6-bis(oxidanylidene)-1H-pyrimidin-2-yl]amino]benzoic acid Openeye Name: 4-[(5-nitro-4,6-dioxo-1H-pyrimidin-2-yl)amino]benzoic acid CAS Name: 4-[(5-nitro-4,6-dioxo-1H-pyrimidin-2-yl)amino]benzoic acid IUPAC Name: 4-[(5-nitro-4,6-dioxo-1H-pyrimidin-2-yl)amino]benzoic acid Traditional Name: 4-[(4,6-diketo-5-nitro-1H-pyrimidin-2-yl)amino]benzoic acid Formula: C11H8N4O6 MolecularWeight: 292.20442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC2=NC(=O)C(C(=O)N2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC2=NC(=O)C(C(=O)N2)[N+](=O)[O-]

InChI

InChI=1S/C11H8N4O6/c16-8-7(15(20)21)9(17)14-11(13-8)12-6-3-1-5(2-4-6)10(18)19/h1-4,7H,(H,18,19)(H2,12,13,14,16,17)