1,3-dimethyl-5-nitro-6-[(E)-2-(5-nitro-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)ethenyl]benzimidazol-2-one

Systemtic Name: 1,3-dimethyl-5-nitro-6-[(E)-2-(5-nitro-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)ethenyl]benzimidazol-2-one Openeye Name: 5-[(E)-2-(4-hydroxy-5-nitro-6-oxo-1H-pyrimidin-2-yl)vinyl]-1,3-dimethyl-6-nitro-benzimidazol-2-one CAS Name: 5-[(E)-2-(4-hydroxy-5-nitro-6-oxo-1H-pyrimidin-2-yl)ethenyl]-1,3-dimethyl-6-nitro-2-benzimidazolone IUPAC Name: 5-[(E)-2-(4-hydroxy-5-nitro-6-oxo-1H-pyrimidin-2-yl)ethenyl]-1,3-dimethyl-6-nitrobenzimidazol-2-one Traditional Name: 5-[(E)-2-(4-hydroxy-6-keto-5-nitro-1H-pyrimidin-2-yl)vinyl]-1,3-dimethyl-6-nitro-benzimidazol-2-one Formula: C15H12N6O7 MolecularWeight: 388.29178

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C(=C2)C=CC3=NC(=C(C(=O)N3)[N+](=O)[O-])O)[N+](=O)[O-])N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C(=C2)/C=C/C3=NC(=C(C(=O)N3)[N+](=O)[O-])O)[N+](=O)[O-])N(C1=O)C

InChI

InChI=1S/C15H12N6O7/c1-18-9-5-7(8(20(25)26)6-10(9)19(2)15(18)24)3-4-11-16-13(22)12(21(27)28)14(23)17-11/h3-6H,1-2H3,(H2,16,17,22,23)/b4-3+