2-azanyl-9-[3,4-bis(hydroxymethyl)oxetan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[3,4-bis(hydroxymethyl)oxetan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[3,4-bis(hydroxymethyl)oxetan-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[3,4-bis(hydroxymethyl)-2-oxetanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[3,4-bis(hydroxymethyl)oxetan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-(3,4-dimethyloloxetan-2-yl)-3H-purin-6-one Formula: C10H13N5O4 MolecularWeight: 267.24132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1C3C(C(O3)CO)CO)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1C3C(C(O3)CO)CO)NC(=NC2=O)N

InChI

InChI=1S/C10H13N5O4/c11-10-13-7-6(8(18)14-10)12-3-15(7)9-4(1-16)5(2-17)19-9/h3-5,9,16-17H,1-2H2,(H3,11,13,14,18)