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

Systemtic Name: 2-azanyl-9-(1-oxidanylbutan-2-yloxymethyl)-3H-purin-6-one Openeye Name: 2-amino-9-[1-(hydroxymethyl)propoxymethyl]-3H-purin-6-one CAS Name: 2-amino-9-(1-hydroxybutan-2-yloxymethyl)-3H-purin-6-one IUPAC Name: 2-amino-9-(1-hydroxybutan-2-yloxymethyl)-3H-purin-6-one Traditional Name: 2-amino-9-(1-methylolpropoxymethyl)-3H-purin-6-one Formula: C10H15N5O3 MolecularWeight: 253.2578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H15N5O3/c1-2-6(3-16)18-5-15-4-12-7-8(15)13-10(11)14-9(7)17/h4,6,16H,2-3,5H2,1H3,(H3,11,13,14,17)