2,8-bis(azanyl)-9-[3-(hydroxymethyl)phenyl]-3H-purin-6-one

Systemtic Name: 2,8-bis(azanyl)-9-[3-(hydroxymethyl)phenyl]-3H-purin-6-one Openeye Name: 2,8-diamino-9-[3-(hydroxymethyl)phenyl]-3H-purin-6-one CAS Name: 2,8-diamino-9-[3-(hydroxymethyl)phenyl]-3H-purin-6-one IUPAC Name: 2,8-diamino-9-[3-(hydroxymethyl)phenyl]-3H-purin-6-one Traditional Name: 2,8-diamino-9-(3-methylolphenyl)-3H-purin-6-one Formula: C12H12N6O2 MolecularWeight: 272.26268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C3=C(C(=O)N=C(N3)N)N=C2N)CO

Isomeric SMILES

C1=CC(=CC(=C1)N2C3=C(C(=O)N=C(N3)N)N=C2N)CO

InChI

InChI=1S/C12H12N6O2/c13-11-16-9-8(10(20)17-11)15-12(14)18(9)7-3-1-2-6(4-7)5-19/h1-4,19H,5H2,(H2,14,15)(H3,13,16,17,20)