5-[1-(4-hydroxyphenyl)-2-nitro-ethyl]-1,3-dimethyl-6-(oxidanylamino)pyrimidine-2,4-dione

Systemtic Name: 5-[1-(4-hydroxyphenyl)-2-nitro-ethyl]-1,3-dimethyl-6-(oxidanylamino)pyrimidine-2,4-dione Openeye Name: 6-(hydroxyamino)-5-[1-(4-hydroxyphenyl)-2-nitro-ethyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-(hydroxyamino)-5-[1-(4-hydroxyphenyl)-2-nitroethyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-(hydroxyamino)-5-[1-(4-hydroxyphenyl)-2-nitroethyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-(hydroxyamino)-5-[1-(4-hydroxyphenyl)-2-nitro-ethyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C14H16N4O6 MolecularWeight: 336.30004

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C(C[N+](=O)[O-])C2=CC=C(C=C2)O)NO

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C(C[N+](=O)[O-])C2=CC=C(C=C2)O)NO

InChI

InChI=1S/C14H16N4O6/c1-16-12(15-22)11(13(20)17(2)14(16)21)10(7-18(23)24)8-3-5-9(19)6-4-8/h3-6,10,15,19,22H,7H2,1-2H3