(5Z)-5-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-4-(7H-purin-6-yl)-1,2,4-triazolidin-3-one

Systemtic Name: (5Z)-5-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-4-(7H-purin-6-yl)-1,2,4-triazolidin-3-one Openeye Name: (5Z)-5-(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-4-(7H-purin-6-yl)-1,2,4-triazolidin-3-one CAS Name: (5Z)-5-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)-4-(7H-purin-6-yl)-1,2,4-triazolidin-3-one IUPAC Name: (5Z)-5-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-4-(7H-purin-6-yl)-1,2,4-triazolidin-3-one Traditional Name: (5Z)-5-(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)-4-(7H-purin-6-yl)-1,2,4-triazolidin-3-one Formula: C13H9N7O3 MolecularWeight: 311.25566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2NNC(=O)N2C3=NC=NC4=C3NC=N4)C(=CC1=O)O

Isomeric SMILES

C1=C/C(=C\2/NNC(=O)N2C3=NC=NC4=C3NC=N4)/C(=CC1=O)O

InChI

InChI=1S/C13H9N7O3/c21-6-1-2-7(8(22)3-6)11-18-19-13(23)20(11)12-9-10(15-4-14-9)16-5-17-12/h1-5,18,22H,(H,19,23)(H,14,15,16,17)/b11-7+