4-(6-chloranyl-2-iodanyl-purin-9-yl)butyl ethanoate

Systemtic Name: 4-(6-chloranyl-2-iodanyl-purin-9-yl)butyl ethanoate Openeye Name: 4-(6-chloro-2-iodo-purin-9-yl)butyl acetate CAS Name: acetic acid 4-(6-chloro-2-iodo-9-purinyl)butyl ester IUPAC Name: 4-(6-chloro-2-iodopurin-9-yl)butyl acetate Traditional Name: acetic acid 4-(6-chloro-2-iodo-purin-9-yl)butyl ester Formula: C11H12ClIN4O2 MolecularWeight: 394.59605

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCN1C=NC2=C1N=C(N=C2Cl)I

Isomeric SMILES

CC(=O)OCCCCN1C=NC2=C1N=C(N=C2Cl)I

InChI

InChI=1S/C11H12ClIN4O2/c1-7(18)19-5-3-2-4-17-6-14-8-9(12)15-11(13)16-10(8)17/h6H,2-5H2,1H3