8-[3,5-bis(oxidanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]-1-methyl-3-phenyl-7,9-dihydropurine-2,6-dione

Systemtic Name: 8-[3,5-bis(oxidanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]-1-methyl-3-phenyl-7,9-dihydropurine-2,6-dione Openeye Name: 8-(3,5-dihydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-1-methyl-3-phenyl-7,9-dihydropurine-2,6-dione CAS Name: 8-(3,5-dihydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)-1-methyl-3-phenyl-7,9-dihydropurine-2,6-dione IUPAC Name: 8-(3,5-dihydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-1-methyl-3-phenyl-7,9-dihydropurine-2,6-dione Traditional Name: 8-(3,5-dihydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)-1-methyl-3-phenyl-7,9-dihydropurine-2,6-quinone Formula: C18H14N4O5 MolecularWeight: 366.32756

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(NC(=C3C=C(C(=O)C(=C3)O)O)N2)N(C1=O)C4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C2=C(NC(=C3C=C(C(=O)C(=C3)O)O)N2)N(C1=O)C4=CC=CC=C4

InChI

InChI=1S/C18H14N4O5/c1-21-17(26)13-16(22(18(21)27)10-5-3-2-4-6-10)20-15(19-13)9-7-11(23)14(25)12(24)8-9/h2-8,19-20,23-24H,1H3