5-[2-(2-azanylpurin-7-yl)ethyl]-2,2-dimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-[2-(2-azanylpurin-7-yl)ethyl]-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-[2-(2-aminopurin-7-yl)ethyl]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[2-(2-amino-7-purinyl)ethyl]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[2-(2-aminopurin-7-yl)ethyl]-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-[2-(2-aminopurin-7-yl)ethyl]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C13H15N5O4 MolecularWeight: 305.2893

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)CCN2C=NC3=NC(=NC=C32)N)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)CCN2C=NC3=NC(=NC=C32)N)C

InChI

InChI=1S/C13H15N5O4/c1-13(2)21-10(19)7(11(20)22-13)3-4-18-6-16-9-8(18)5-15-12(14)17-9/h5-7H,3-4H2,1-2H3,(H2,14,15,17)