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

Systemtic Name: 2-azanyl-9-(1-oxidanylbut-3-en-2-yloxymethyl)-3H-purin-6-one Openeye Name: 2-amino-9-[1-(hydroxymethyl)allyloxymethyl]-3H-purin-6-one CAS Name: 2-amino-9-(1-hydroxybut-3-en-2-yloxymethyl)-3H-purin-6-one IUPAC Name: 2-amino-9-(1-hydroxybut-3-en-2-yloxymethyl)-3H-purin-6-one Traditional Name: 2-amino-9-(1-methylolallyloxymethyl)-3H-purin-6-one Formula: C10H13N5O3 MolecularWeight: 251.24192

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(CO)OCN1C=NC2=C1NC(=NC2=O)N

Isomeric SMILES

C=CC(CO)OCN1C=NC2=C1NC(=NC2=O)N

InChI

InChI=1S/C10H13N5O3/c1-2-6(3-16)18-5-15-4-12-7-8(15)13-10(11)14-9(7)17/h2,4,6,16H,1,3,5H2,(H3,11,13,14,17)