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

Systemtic Name: 6-[2-(3-bromanyl-5-nitro-2-oxidanyl-phenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione Openeye Name: 6-[2-(3-bromo-2-hydroxy-5-nitro-phenyl)vinyl]-5-nitro-1H-pyrimidine-2,4-dione CAS Name: 6-[2-(3-bromo-2-hydroxy-5-nitrophenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione IUPAC Name: 6-[2-(3-bromo-2-hydroxy-5-nitrophenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione Traditional Name: 6-[2-(3-bromo-2-hydroxy-5-nitro-phenyl)vinyl]-5-nitro-uracil Formula: C12H7BrN4O7 MolecularWeight: 399.11058

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Br)O)C=CC2=C(C(=O)NC(=O)N2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1Br)O)C=CC2=C(C(=O)NC(=O)N2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H7BrN4O7/c13-7-4-6(16(21)22)3-5(10(7)18)1-2-8-9(17(23)24)11(19)15-12(20)14-8/h1-4,18H,(H2,14,15,19,20)