[5-(6-chloranylpurin-9-yl)-3,4-di(propanoyloxy)oxolan-2-yl]methyl propanoate

Systemtic Name: [5-(6-chloranylpurin-9-yl)-3,4-di(propanoyloxy)oxolan-2-yl]methyl propanoate Openeye Name: [5-(6-chloropurin-9-yl)-3,4-di(propanoyloxy)tetrahydrofuran-2-yl]methyl propanoate CAS Name: propanoic acid [5-(6-chloro-9-purinyl)-3,4-bis(1-oxopropoxy)-2-oxolanyl]methyl ester IUPAC Name: [5-(6-chloropurin-9-yl)-3,4-di(propanoyloxy)oxolan-2-yl]methyl propanoate Traditional Name: propionic acid [5-(6-chloropurin-9-yl)-3,4-dipropionyloxy-tetrahydrofuran-2-yl]methyl ester Formula: C19H23ClN4O7 MolecularWeight: 454.86152

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3Cl)OC(=O)CC)OC(=O)CC

Isomeric SMILES

CCC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3Cl)OC(=O)CC)OC(=O)CC

InChI

InChI=1S/C19H23ClN4O7/c1-4-11(25)28-7-10-15(30-12(26)5-2)16(31-13(27)6-3)19(29-10)24-9-23-14-17(20)21-8-22-18(14)24/h8-10,15-16,19H,4-7H2,1-3H3