2-azanyl-7,9-dihydro-3H-purine-6,8-dione; 9H-purine-6,8-dione

Systemtic Name: 2-azanyl-7,9-dihydro-3H-purine-6,8-dione; 9H-purine-6,8-dione Openeye Name: 2-amino-7,9-dihydro-3H-purine-6,8-dione; 9H-purine-6,8-dione CAS Name: 2-amino-7,9-dihydro-3H-purine-6,8-dione; 9H-purine-6,8-dione IUPAC Name: 2-amino-7,9-dihydro-3H-purine-6,8-dione; 9H-purine-6,8-dione Traditional Name: 2-amino-7,9-dihydro-3H-purine-6,8-quinone; 9H-purine-6,8-quinone Formula: C10H7N9O4 MolecularWeight: 317.22048

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=O)C2=NC(=O)NC2=N1.C12=C(NC(=NC1=O)N)NC(=O)N2

Isomeric SMILES

C1=NC(=O)C2=NC(=O)NC2=N1.C12=C(NC(=NC1=O)N)NC(=O)N2

InChI

InChI=1S/C5H5N5O2.C5H2N4O2/c6-4-8-2-1(3(11)10-4)7-5(12)9-2;10-4-2-3(6-1-7-4)9-5(11)8-2/h(H5,6,7,8,9,10,11,12);1H,(H,6,7,9,10,11)