2-azanyl-7-(2-hydroxyethyloxymethyl)-1-(hydroxymethyl)purin-6-one

Systemtic Name: 2-azanyl-7-(2-hydroxyethyloxymethyl)-1-(hydroxymethyl)purin-6-one Openeye Name: 2-amino-7-(2-hydroxyethoxymethyl)-1-(hydroxymethyl)purin-6-one CAS Name: 2-amino-7-(2-hydroxyethoxymethyl)-1-(hydroxymethyl)-6-purinone IUPAC Name: 2-amino-7-(2-hydroxyethoxymethyl)-1-(hydroxymethyl)purin-6-one Traditional Name: 2-amino-7-(2-hydroxyethoxymethyl)-1-methylol-purin-6-one Formula: C9H13N5O4 MolecularWeight: 255.23062

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1COCCO)C(=O)N(C(=N2)N)CO

Isomeric SMILES

C1=NC2=C(N1COCCO)C(=O)N(C(=N2)N)CO

InChI

InChI=1S/C9H13N5O4/c10-9-12-7-6(8(17)14(9)4-16)13(3-11-7)5-18-2-1-15/h3,15-16H,1-2,4-5H2,(H2,10,12)