2-(methylamino)-9-(1-oxidanylbutan-2-yloxymethyl)-3H-purin-6-one

Systemtic Name: 2-(methylamino)-9-(1-oxidanylbutan-2-yloxymethyl)-3H-purin-6-one Openeye Name: 9-[1-(hydroxymethyl)propoxymethyl]-2-(methylamino)-3H-purin-6-one CAS Name: 9-(1-hydroxybutan-2-yloxymethyl)-2-(methylamino)-3H-purin-6-one IUPAC Name: 9-(1-hydroxybutan-2-yloxymethyl)-2-(methylamino)-3H-purin-6-one Traditional Name: 2-(methylamino)-9-(1-methylolpropoxymethyl)-3H-purin-6-one Formula: C11H17N5O3 MolecularWeight: 267.28438

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)OCN1C=NC2=C1NC(=NC2=O)NC

Isomeric SMILES

CCC(CO)OCN1C=NC2=C1NC(=NC2=O)NC

InChI

InChI=1S/C11H17N5O3/c1-3-7(4-17)19-6-16-5-13-8-9(16)14-11(12-2)15-10(8)18/h5,7,17H,3-4,6H2,1-2H3,(H2,12,14,15,18)