8-azanyl-2-(2-methoxy-5-oxidanyl-phenyl)purin-6-one

Systemtic Name: 8-azanyl-2-(2-methoxy-5-oxidanyl-phenyl)purin-6-one Openeye Name: 8-amino-2-(5-hydroxy-2-methoxy-phenyl)purin-6-one CAS Name: 8-amino-2-(5-hydroxy-2-methoxyphenyl)-6-purinone IUPAC Name: 8-amino-2-(5-hydroxy-2-methoxyphenyl)purin-6-one Traditional Name: 8-amino-2-(5-hydroxy-2-methoxy-phenyl)purin-6-one Formula: C12H9N5O3 MolecularWeight: 271.23156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)O)C2=NC(=O)C3=NC(=NC3=N2)N

Isomeric SMILES

COC1=C(C=C(C=C1)O)C2=NC(=O)C3=NC(=NC3=N2)N

InChI

InChI=1S/C12H9N5O3/c1-20-7-3-2-5(18)4-6(7)9-15-10-8(11(19)16-9)14-12(13)17-10/h2-4,18H,1H3,(H2,13,15,16,17,19)