8-azanyl-2-(2-methoxyphenyl)purin-6-one hydrate

Systemtic Name: 8-azanyl-2-(2-methoxyphenyl)purin-6-one hydrate Openeye Name: 8-amino-2-(2-methoxyphenyl)purin-6-one hydrate CAS Name: 8-amino-2-(2-methoxyphenyl)-6-purinone hydrate IUPAC Name: 8-amino-2-(2-methoxyphenyl)purin-6-one hydrate Traditional Name: 8-amino-2-(2-methoxyphenyl)purin-6-one hydrate Formula: C12H11N5O3 MolecularWeight: 273.24744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC(=O)C3=NC(=NC3=N2)N.O

Isomeric SMILES

COC1=CC=CC=C1C2=NC(=O)C3=NC(=NC3=N2)N.O

InChI

InChI=1S/C12H9N5O2.H2O/c1-19-7-5-3-2-4-6(7)9-15-10-8(11(18)16-9)14-12(13)17-10;/h2-5H,1H3,(H2,13,15,16,17,18);1H2