(6-chloranyl-2-iodanyl-purin-9-yl)methyl 2,2-dimethylpropanoate

Systemtic Name: (6-chloranyl-2-iodanyl-purin-9-yl)methyl 2,2-dimethylpropanoate Openeye Name: (6-chloro-2-iodo-purin-9-yl)methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid (6-chloro-2-iodo-9-purinyl)methyl ester IUPAC Name: (6-chloro-2-iodopurin-9-yl)methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid (6-chloro-2-iodo-purin-9-yl)methyl ester Formula: C11H12ClIN4O2 MolecularWeight: 394.59605

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C=NC2=C1N=C(N=C2Cl)I

Isomeric SMILES

CC(C)(C)C(=O)OCN1C=NC2=C1N=C(N=C2Cl)I

InChI

InChI=1S/C11H12ClIN4O2/c1-11(2,3)9(18)19-5-17-4-14-6-7(12)15-10(13)16-8(6)17/h4H,5H2,1-3H3