6-[bis(oxidanyl)methylidene]-2-(2-nitro-3-phenylmethoxy-phenyl)-1H-pyrimidine-4,5-dione

Systemtic Name: 6-[bis(oxidanyl)methylidene]-2-(2-nitro-3-phenylmethoxy-phenyl)-1H-pyrimidine-4,5-dione Openeye Name: 2-(3-benzyloxy-2-nitro-phenyl)-6-(dihydroxymethylene)-1H-pyrimidine-4,5-dione CAS Name: 6-(dihydroxymethylidene)-2-(2-nitro-3-phenylmethoxyphenyl)-1H-pyrimidine-4,5-dione IUPAC Name: 6-(dihydroxymethylidene)-2-(2-nitro-3-phenylmethoxyphenyl)-1H-pyrimidine-4,5-dione Traditional Name: 2-(3-benzoxy-2-nitro-phenyl)-6-(dihydroxymethylene)-1H-pyrimidine-4,5-quinone Formula: C18H13N3O7 MolecularWeight: 383.31172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2[N+](=O)[O-])C3=NC(=O)C(=O)C(=C(O)O)N3

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2[N+](=O)[O-])C3=NC(=O)C(=O)C(=C(O)O)N3

InChI

InChI=1S/C18H13N3O7/c22-15-13(18(24)25)19-16(20-17(15)23)11-7-4-8-12(14(11)21(26)27)28-9-10-5-2-1-3-6-10/h1-8,24-25H,9H2,(H,19,20,23)