2-[[8-bromanyl-2-[ethanoyl(methyl)amino]-1-methyl-6-oxidanylidene-purin-9-yl]methoxy]ethyl ethanoate

Systemtic Name: 2-[[8-bromanyl-2-[ethanoyl(methyl)amino]-1-methyl-6-oxidanylidene-purin-9-yl]methoxy]ethyl ethanoate Openeye Name: 2-[[2-[acetyl(methyl)amino]-8-bromo-1-methyl-6-oxo-purin-9-yl]methoxy]ethyl acetate CAS Name: acetic acid 2-[[2-[acetyl(methyl)amino]-8-bromo-1-methyl-6-oxo-9-purinyl]methoxy]ethyl ester IUPAC Name: 2-[[2-[acetyl(methyl)amino]-8-bromo-1-methyl-6-oxopurin-9-yl]methoxy]ethyl acetate Traditional Name: acetic acid 2-[[2-[acetyl(methyl)amino]-8-bromo-6-keto-1-methyl-purin-9-yl]methoxy]ethyl ester Formula: C14H18BrN5O5 MolecularWeight: 416.22722

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)C1=NC2=C(C(=O)N1C)N=C(N2COCCOC(=O)C)Br

Isomeric SMILES

CC(=O)N(C)C1=NC2=C(C(=O)N1C)N=C(N2COCCOC(=O)C)Br

InChI

InChI=1S/C14H18BrN5O5/c1-8(21)18(3)14-17-11-10(12(23)19(14)4)16-13(15)20(11)7-24-5-6-25-9(2)22/h5-7H2,1-4H3