2-[5-nitro-1-(3-nitrophenyl)-2-oxidanylidene-pyrimidin-4-yl]ethanoic acid

Systemtic Name: 2-[5-nitro-1-(3-nitrophenyl)-2-oxidanylidene-pyrimidin-4-yl]ethanoic acid Openeye Name: 2-[5-nitro-1-(3-nitrophenyl)-2-oxo-pyrimidin-4-yl]acetic acid CAS Name: 2-[5-nitro-1-(3-nitrophenyl)-2-oxo-4-pyrimidinyl]acetic acid IUPAC Name: 2-[5-nitro-1-(3-nitrophenyl)-2-oxopyrimidin-4-yl]acetic acid Traditional Name: 2-[2-keto-5-nitro-1-(3-nitrophenyl)pyrimidin-4-yl]acetic acid Formula: C12H8N4O7 MolecularWeight: 320.21452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C=C(C(=NC2=O)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2C=C(C(=NC2=O)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H8N4O7/c17-11(18)5-9-10(16(22)23)6-14(12(19)13-9)7-2-1-3-8(4-7)15(20)21/h1-4,6H,5H2,(H,17,18)