2-azanyl-9-[4,4-diethoxy-2-(hydroxymethyl)butyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[4,4-diethoxy-2-(hydroxymethyl)butyl]-3H-purin-6-one Openeye Name: 2-amino-9-[4,4-diethoxy-2-(hydroxymethyl)butyl]-3H-purin-6-one CAS Name: 2-amino-9-[4,4-diethoxy-2-(hydroxymethyl)butyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[4,4-diethoxy-2-(hydroxymethyl)butyl]-3H-purin-6-one Traditional Name: 2-amino-9-(4,4-diethoxy-2-methylol-butyl)-3H-purin-6-one Formula: C14H23N5O4 MolecularWeight: 325.36352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC(CN1C=NC2=C1NC(=NC2=O)N)CO)OCC

Isomeric SMILES

CCOC(CC(CN1C=NC2=C1NC(=NC2=O)N)CO)OCC

InChI

InChI=1S/C14H23N5O4/c1-3-22-10(23-4-2)5-9(7-20)6-19-8-16-11-12(19)17-14(15)18-13(11)21/h8-10,20H,3-7H2,1-2H3,(H3,15,17,18,21)