3-[[6-ethoxy-2-(methylamino)purin-9-yl]-propoxycarbonyloxy-methoxy]propyl propyl carbonate

Systemtic Name: 3-[[6-ethoxy-2-(methylamino)purin-9-yl]-propoxycarbonyloxy-methoxy]propyl propyl carbonate Openeye Name: 3-[[6-ethoxy-2-(methylamino)purin-9-yl]-propoxycarbonyloxy-methoxy]propyl propyl carbonate CAS Name: carbonic acid 3-[[6-ethoxy-2-(methylamino)-9-purinyl]-[oxo(propoxy)methoxy]methoxy]propyl propyl ester IUPAC Name: 3-[[6-ethoxy-2-(methylamino)purin-9-yl]-propoxycarbonyloxymethoxy]propyl propyl carbonate Traditional Name: carbonic acid 3-[[6-ethoxy-2-(methylamino)purin-9-yl]-propoxycarbonyloxy-methoxy]propyl propyl ester Formula: C20H31N5O8 MolecularWeight: 469.48884

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)OCCCOC(N1C=NC2=C1N=C(N=C2OCC)NC)OC(=O)OCCC

Isomeric SMILES

CCCOC(=O)OCCCOC(N1C=NC2=C1N=C(N=C2OCC)NC)OC(=O)OCCC

InChI

InChI=1S/C20H31N5O8/c1-5-9-30-19(26)32-12-8-11-29-18(33-20(27)31-10-6-2)25-13-22-14-15(25)23-17(21-4)24-16(14)28-7-3/h13,18H,5-12H2,1-4H3,(H,21,23,24)