2-(6-chloranyl-2-iodanyl-purin-9-yl)oxyethyl ethanoate

Systemtic Name: 2-(6-chloranyl-2-iodanyl-purin-9-yl)oxyethyl ethanoate Openeye Name: 2-(6-chloro-2-iodo-purin-9-yl)oxyethyl acetate CAS Name: acetic acid 2-[(6-chloro-2-iodo-9-purinyl)oxy]ethyl ester IUPAC Name: 2-(6-chloro-2-iodopurin-9-yl)oxyethyl acetate Traditional Name: acetic acid 2-(6-chloro-2-iodo-purin-9-yl)oxyethyl ester Formula: C9H8ClIN4O3 MolecularWeight: 382.54229

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCON1C=NC2=C1N=C(N=C2Cl)I

Isomeric SMILES

CC(=O)OCCON1C=NC2=C1N=C(N=C2Cl)I

InChI

InChI=1S/C9H8ClIN4O3/c1-5(16)17-2-3-18-15-4-12-6-7(10)13-9(11)14-8(6)15/h4H,2-3H2,1H3