8-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-methyl-7,9-dihydropurine-2,6-dione

Systemtic Name: 8-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-methyl-7,9-dihydropurine-2,6-dione Openeye Name: 8-(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-3-methyl-7,9-dihydropurine-2,6-dione CAS Name: 8-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-3-methyl-7,9-dihydropurine-2,6-dione IUPAC Name: 8-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-3-methyl-7,9-dihydropurine-2,6-dione Traditional Name: 8-(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)-3-methyl-7,9-dihydropurine-2,6-quinone Formula: C13H12N4O4 MolecularWeight: 288.25878

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)NC(=C3C=CC(=O)C(=C3)OC)N2

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)NC(=C3C=CC(=O)C(=C3)OC)N2

InChI

InChI=1S/C13H12N4O4/c1-17-11-9(12(19)16-13(17)20)14-10(15-11)6-3-4-7(18)8(5-6)21-2/h3-5,14-15H,1-2H3,(H,16,19,20)