2-azanyl-9-(2-hydroxyethyloxymethyl)-3H-purin-6-one

Systemtic Name: 2-azanyl-9-(2-hydroxyethyloxymethyl)-3H-purin-6-one Openeye Name: 2-amino-9-(2-hydroxyethoxymethyl)-3H-purin-6-one CAS Name: 2-amino-9-(2-hydroxyethoxymethyl)-3H-purin-6-one IUPAC Name: 2-amino-9-(2-hydroxyethoxymethyl)-3H-purin-6-one Traditional Name: 2-amino-9-(2-hydroxyethoxymethyl)-3H-purin-6-one Formula: C16H22N10O6 MolecularWeight: 450.40928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1COCCO)NC(=NC2=O)N.C1=NC2=C(N1COCCO)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1COCCO)NC(=NC2=O)N.C1=NC2=C(N1COCCO)NC(=NC2=O)N

InChI

InChI=1S/2C8H11N5O3/c2*9-8-11-6-5(7(15)12-8)10-3-13(6)4-16-2-1-14/h2*3,14H,1-2,4H2,(H3,9,11,12,15)