acetyloxymethyl 2-[3-[[6-azanyl-2-(2-ethoxyethoxy)-8-oxidanylidene-7H-purin-9-yl]methyl]phenyl]ethanoate

Systemtic Name: acetyloxymethyl 2-[3-[[6-azanyl-2-(2-ethoxyethoxy)-8-oxidanylidene-7H-purin-9-yl]methyl]phenyl]ethanoate Openeye Name: acetoxymethyl 2-[3-[[6-amino-2-(2-ethoxyethoxy)-8-oxo-7H-purin-9-yl]methyl]phenyl]acetate CAS Name: 2-[3-[[6-amino-2-(2-ethoxyethoxy)-8-oxo-7H-purin-9-yl]methyl]phenyl]acetic acid acetyloxymethyl ester IUPAC Name: acetyloxymethyl 2-[3-[[6-amino-2-(2-ethoxyethoxy)-8-oxo-7H-purin-9-yl]methyl]phenyl]acetate Traditional Name: 2-[3-[[6-amino-2-(2-ethoxyethoxy)-8-keto-7H-purin-9-yl]methyl]phenyl]acetic acid acetoxymethyl ester Formula: C21H25N5O7 MolecularWeight: 459.4525

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CC=CC(=C3)CC(=O)OCOC(=O)C

Isomeric SMILES

CCOCCOC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CC=CC(=C3)CC(=O)OCOC(=O)C

InChI

InChI=1S/C21H25N5O7/c1-3-30-7-8-31-20-24-18(22)17-19(25-20)26(21(29)23-17)11-15-6-4-5-14(9-15)10-16(28)33-12-32-13(2)27/h4-6,9H,3,7-8,10-12H2,1-2H3,(H,23,29)(H2,22,24,25)