2-azanyl-9-[1,3-di(propan-2-yloxy)propan-2-yloxymethyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[1,3-di(propan-2-yloxy)propan-2-yloxymethyl]-3H-purin-6-one Openeye Name: 2-amino-9-[[2-isopropoxy-1-(isopropoxymethyl)ethoxy]methyl]-3H-purin-6-one CAS Name: 2-amino-9-[1,3-di(propan-2-yloxy)propan-2-yloxymethyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[1,3-di(propan-2-yloxy)propan-2-yloxymethyl]-3H-purin-6-one Traditional Name: 2-amino-9-[[2-isopropoxy-1-(isopropoxymethyl)ethoxy]methyl]-3H-purin-6-one Formula: C15H25N5O4 MolecularWeight: 339.3901

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC(COC(C)C)OCN1C=NC2=C1NC(=NC2=O)N

Isomeric SMILES

CC(C)OCC(COC(C)C)OCN1C=NC2=C1NC(=NC2=O)N

InChI

InChI=1S/C15H25N5O4/c1-9(2)22-5-11(6-23-10(3)4)24-8-20-7-17-12-13(20)18-15(16)19-14(12)21/h7,9-11H,5-6,8H2,1-4H3,(H3,16,18,19,21)