methyl 2,3-diacetyloxy-4-(6-aminopurin-9-yl)butanoate

Systemtic Name: methyl 2,3-diacetyloxy-4-(6-aminopurin-9-yl)butanoate Openeye Name: methyl 2,3-diacetoxy-4-(6-aminopurin-9-yl)butanoate CAS Name: 2,3-diacetyloxy-4-(6-aminopurin-9-yl)butanoic acid methyl ester IUPAC Name: methyl 2,3-diacetyloxy-4-(6-aminopurin-9-yl)butanoate Traditional Name: 2,3-diacetoxy-4-adenin-9-yl-butyric acid methyl ester Formula: C14H17N5O6 MolecularWeight: 351.31468

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CN1C=NC2=C1N=CN=C2N)C(C(=O)OC)OC(=O)C

Isomeric SMILES

CC(=O)OC(CN1C=NC2=C1N=CN=C2N)C(C(=O)OC)OC(=O)C

InChI

InChI=1S/C14H17N5O6/c1-7(20)24-9(11(14(22)23-3)25-8(2)21)4-19-6-18-10-12(15)16-5-17-13(10)19/h5-6,9,11H,4H2,1-3H3,(H2,15,16,17)