4-[2,6-bis(chloranyl)purin-7-yl]butyl ethanoate

Systemtic Name: 4-[2,6-bis(chloranyl)purin-7-yl]butyl ethanoate Openeye Name: 4-(2,6-dichloropurin-7-yl)butyl acetate CAS Name: acetic acid 4-(2,6-dichloro-7-purinyl)butyl ester IUPAC Name: 4-(2,6-dichloropurin-7-yl)butyl acetate Traditional Name: acetic acid 4-(2,6-dichloropurin-7-yl)butyl ester Formula: C11H12Cl2N4O2 MolecularWeight: 303.14458

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCN1C=NC2=C1C(=NC(=N2)Cl)Cl

Isomeric SMILES

CC(=O)OCCCCN1C=NC2=C1C(=NC(=N2)Cl)Cl

InChI

InChI=1S/C11H12Cl2N4O2/c1-7(18)19-5-3-2-4-17-6-14-10-8(17)9(12)15-11(13)16-10/h6H,2-5H2,1H3