6-chloranyl-7-[2-(2,2-dimethyl-1,3-dioxan-5-yl)ethyl]purin-2-amine

Systemtic Name: 6-chloranyl-7-[2-(2,2-dimethyl-1,3-dioxan-5-yl)ethyl]purin-2-amine Openeye Name: 6-chloro-7-[2-(2,2-dimethyl-1,3-dioxan-5-yl)ethyl]purin-2-amine CAS Name: 6-chloro-7-[2-(2,2-dimethyl-1,3-dioxan-5-yl)ethyl]-2-purinamine IUPAC Name: 6-chloro-7-[2-(2,2-dimethyl-1,3-dioxan-5-yl)ethyl]purin-2-amine Traditional Name: [6-chloro-7-[2-(2,2-dimethyl-1,3-dioxan-5-yl)ethyl]purin-2-yl]amine Formula: C13H18ClN5O2 MolecularWeight: 311.76732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)CCN2C=NC3=C2C(=NC(=N3)N)Cl)C

Isomeric SMILES

CC1(OCC(CO1)CCN2C=NC3=C2C(=NC(=N3)N)Cl)C

InChI

InChI=1S/C13H18ClN5O2/c1-13(2)20-5-8(6-21-13)3-4-19-7-16-11-9(19)10(14)17-12(15)18-11/h7-8H,3-6H2,1-2H3,(H2,15,17,18)