1,3-dimethyl-8-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-7,9-dihydropurine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-7,9-dihydropurine-2,6-dione Openeye Name: 1,3-dimethyl-8-(4-oxocyclohexa-2,5-dien-1-ylidene)-7,9-dihydropurine-2,6-dione CAS Name: 1,3-dimethyl-8-(4-oxo-1-cyclohexa-2,5-dienylidene)-7,9-dihydropurine-2,6-dione IUPAC Name: 1,3-dimethyl-8-(4-oxocyclohexa-2,5-dien-1-ylidene)-7,9-dihydropurine-2,6-dione Traditional Name: 8-(4-ketocyclohexa-2,5-dien-1-ylidene)-1,3-dimethyl-7,9-dihydropurine-2,6-quinone Formula: C13H12N4O3 MolecularWeight: 272.25938

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=C3C=CC(=O)C=C3)N2

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=C3C=CC(=O)C=C3)N2

InChI

InChI=1S/C13H12N4O3/c1-16-11-9(12(19)17(2)13(16)20)14-10(15-11)7-3-5-8(18)6-4-7/h3-6,14-15H,1-2H3