6-[(E)-2-(3-methoxy-5-nitro-2-oxidanyl-phenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione

Systemtic Name: 6-[(E)-2-(3-methoxy-5-nitro-2-oxidanyl-phenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione Openeye Name: 6-[(E)-2-(2-hydroxy-3-methoxy-5-nitro-phenyl)vinyl]-5-nitro-1H-pyrimidine-2,4-dione CAS Name: 6-[(E)-2-(2-hydroxy-3-methoxy-5-nitrophenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione IUPAC Name: 6-[(E)-2-(2-hydroxy-3-methoxy-5-nitrophenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione Traditional Name: 6-[(E)-2-(2-hydroxy-3-methoxy-5-nitro-phenyl)vinyl]-5-nitro-uracil Formula: C13H10N4O8 MolecularWeight: 350.2405

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)[N+](=O)[O-])C=CC2=C(C(=O)NC(=O)N2)[N+](=O)[O-])O

Isomeric SMILES

COC1=C(C(=CC(=C1)[N+](=O)[O-])/C=C/C2=C(C(=O)NC(=O)N2)[N+](=O)[O-])O

InChI

InChI=1S/C13H10N4O8/c1-25-9-5-7(16(21)22)4-6(11(9)18)2-3-8-10(17(23)24)12(19)15-13(20)14-8/h2-5,18H,1H3,(H2,14,15,19,20)/b3-2+