1,3,7-trimethyl-8-[2-[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]purine-2,6-dione

Systemtic Name: 1,3,7-trimethyl-8-[2-[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]purine-2,6-dione Openeye Name: 8-[2-[(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-1,3,7-trimethyl-purine-2,6-dione CAS Name: 8-[(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-1,3,7-trimethylpurine-2,6-dione IUPAC Name: 8-[2-[(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-1,3,7-trimethylpurine-2,6-dione Traditional Name: 8-[N'-[(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-1,3,7-trimethyl-xanthine Formula: C15H16N6O4 MolecularWeight: 344.32534

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1NNC=C3C=CC(=O)C=C3O)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CN1C2=C(N=C1NNC=C3C=CC(=O)C=C3O)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C15H16N6O4/c1-19-11-12(20(2)15(25)21(3)13(11)24)17-14(19)18-16-7-8-4-5-9(22)6-10(8)23/h4-7,16,23H,1-3H3,(H,17,18)