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

Systemtic Name: (8E)-1,3-dimethyl-8-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-7,9-dihydropurine-2,6-dione Openeye Name: (8E)-1,3-dimethyl-8-(6-oxocyclohexa-2,4-dien-1-ylidene)-7,9-dihydropurine-2,6-dione CAS Name: (8E)-1,3-dimethyl-8-(6-oxo-1-cyclohexa-2,4-dienylidene)-7,9-dihydropurine-2,6-dione IUPAC Name: (8E)-1,3-dimethyl-8-(6-oxocyclohexa-2,4-dien-1-ylidene)-7,9-dihydropurine-2,6-dione Traditional Name: (8E)-8-(6-ketocyclohexa-2,4-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=CC3=O)N2

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N/C(=C\3/C=CC=CC3=O)/N2

InChI

InChI=1S/C13H12N4O3/c1-16-11-9(12(19)17(2)13(16)20)14-10(15-11)7-5-3-4-6-8(7)18/h3-6,14-15H,1-2H3/b10-7+