2-[(4-methoxy-3-nitro-phenyl)amino]-5-nitro-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[(4-methoxy-3-nitro-phenyl)amino]-5-nitro-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-2-(4-methoxy-3-nitro-anilino)-5-nitro-1H-pyrimidin-6-one CAS Name: 4-hydroxy-2-(4-methoxy-3-nitroanilino)-5-nitro-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-2-(4-methoxy-3-nitroanilino)-5-nitro-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-2-(4-methoxy-3-nitro-anilino)-5-nitro-1H-pyrimidin-6-one Formula: C11H9N5O7 MolecularWeight: 323.21846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC(=C(C(=O)N2)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC(=C(C(=O)N2)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C11H9N5O7/c1-23-7-3-2-5(4-6(7)15(19)20)12-11-13-9(17)8(16(21)22)10(18)14-11/h2-4H,1H3,(H3,12,13,14,17,18)