2-[(2-acetamido-6-chloranyl-purin-9-yl)methoxy]ethyl ethanoate

Systemtic Name: 2-[(2-acetamido-6-chloranyl-purin-9-yl)methoxy]ethyl ethanoate Openeye Name: 2-[(2-acetamido-6-chloro-purin-9-yl)methoxy]ethyl acetate CAS Name: acetic acid 2-[(2-acetamido-6-chloro-9-purinyl)methoxy]ethyl ester IUPAC Name: 2-[(2-acetamido-6-chloropurin-9-yl)methoxy]ethyl acetate Traditional Name: acetic acid 2-[(2-acetamido-6-chloro-purin-9-yl)methoxy]ethyl ester Formula: C12H14ClN5O4 MolecularWeight: 327.72366

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(C(=N1)Cl)N=CN2COCCOC(=O)C

Isomeric SMILES

CC(=O)NC1=NC2=C(C(=N1)Cl)N=CN2COCCOC(=O)C

InChI

InChI=1S/C12H14ClN5O4/c1-7(19)15-12-16-10(13)9-11(17-12)18(5-14-9)6-21-3-4-22-8(2)20/h5H,3-4,6H2,1-2H3,(H,15,16,17,19)