methyl 2-[3,4-diacetyloxy-5-[8-chloranyl-6-(methylamino)purin-9-yl]oxolan-2-yl]ethanoate

Systemtic Name: methyl 2-[3,4-diacetyloxy-5-[8-chloranyl-6-(methylamino)purin-9-yl]oxolan-2-yl]ethanoate Openeye Name: methyl 2-[3,4-diacetoxy-5-[8-chloro-6-(methylamino)purin-9-yl]tetrahydrofuran-2-yl]acetate CAS Name: 2-[3,4-diacetyloxy-5-[8-chloro-6-(methylamino)-9-purinyl]-2-oxolanyl]acetic acid methyl ester IUPAC Name: methyl 2-[3,4-diacetyloxy-5-[8-chloro-6-(methylamino)purin-9-yl]oxolan-2-yl]acetate Traditional Name: 2-[3,4-diacetoxy-5-[8-chloro-6-(methylamino)purin-9-yl]tetrahydrofuran-2-yl]acetic acid methyl ester Formula: C17H20ClN5O7 MolecularWeight: 441.823

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(OC(C1OC(=O)C)N2C3=C(C(=NC=N3)NC)N=C2Cl)CC(=O)OC

Isomeric SMILES

CC(=O)OC1C(OC(C1OC(=O)C)N2C3=C(C(=NC=N3)NC)N=C2Cl)CC(=O)OC

InChI

InChI=1S/C17H20ClN5O7/c1-7(24)28-12-9(5-10(26)27-4)30-16(13(12)29-8(2)25)23-15-11(22-17(23)18)14(19-3)20-6-21-15/h6,9,12-13,16H,5H2,1-4H3,(H,19,20,21)