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

Systemtic Name: 2-[3-(3-nitrophenyl)-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]ethanoic acid Openeye Name: 2-[3-(3-nitrophenyl)-2,4-dioxo-1H-pyrimidin-5-yl]acetic acid CAS Name: 2-[3-(3-nitrophenyl)-2,4-dioxo-1H-pyrimidin-5-yl]acetic acid IUPAC Name: 2-[3-(3-nitrophenyl)-2,4-dioxo-1H-pyrimidin-5-yl]acetic acid Traditional Name: 2-[2,4-diketo-3-(3-nitrophenyl)-1H-pyrimidin-5-yl]acetic acid Formula: C12H9N3O6 MolecularWeight: 291.21636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C(=CNC2=O)CC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C(=CNC2=O)CC(=O)O

InChI

InChI=1S/C12H9N3O6/c16-10(17)4-7-6-13-12(19)14(11(7)18)8-2-1-3-9(5-8)15(20)21/h1-3,5-6H,4H2,(H,13,19)(H,16,17)