[3,4-diacetyloxy-5-(2-azanyl-8-ethanoyl-6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methyl ethanoate

Systemtic Name: [3,4-diacetyloxy-5-(2-azanyl-8-ethanoyl-6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methyl ethanoate Openeye Name: [3,4-diacetoxy-5-(8-acetyl-2-amino-6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [5-(8-acetyl-2-amino-6-oxo-3H-purin-9-yl)-3,4-diacetyloxy-2-oxolanyl]methyl ester IUPAC Name: [5-(8-acetyl-2-amino-6-oxo-3H-purin-9-yl)-3,4-diacetyloxyoxolan-2-yl]methyl acetate Traditional Name: acetic acid [3,4-diacetoxy-5-(8-acetyl-2-amino-6-keto-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl ester Formula: C18H21N5O9 MolecularWeight: 451.38744

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NC2=C(N1C3C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)NC(=NC2=O)N

Isomeric SMILES

CC(=O)C1=NC2=C(N1C3C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)NC(=NC2=O)N

InChI

InChI=1S/C18H21N5O9/c1-6(24)14-20-11-15(21-18(19)22-16(11)28)23(14)17-13(31-9(4)27)12(30-8(3)26)10(32-17)5-29-7(2)25/h10,12-13,17H,5H2,1-4H3,(H3,19,21,22,28)