1-[1-(6-aminopurin-9-yl)propan-2-yloxymethyl-(1-propoxycarbonyloxyethoxy)phosphoryl]oxyethyl propyl carbonate

Systemtic Name: 1-[1-(6-aminopurin-9-yl)propan-2-yloxymethyl-(1-propoxycarbonyloxyethoxy)phosphoryl]oxyethyl propyl carbonate Openeye Name: 1-[[2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methyl-(1-propoxycarbonyloxyethoxy)phosphoryl]oxyethyl propyl carbonate CAS Name: carbonic acid 1-[1-(6-aminopurin-9-yl)propan-2-yloxymethyl-[1-[oxo(propoxy)methoxy]ethoxy]phosphoryl]oxyethyl propyl ester IUPAC Name: 1-[1-(6-aminopurin-9-yl)propan-2-yloxymethyl-(1-propoxycarbonyloxyethoxy)phosphoryl]oxyethyl propyl carbonate Traditional Name: carbonic acid 1-[(2-adenin-9-yl-1-methyl-ethoxy)methyl-(1-propoxycarbonyloxyethoxy)phosphoryl]oxyethyl propyl ester Formula: C21H34N5O10P MolecularWeight: 547.495921

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)OC(C)OP(=O)(COC(C)CN1C=NC2=C1N=CN=C2N)OC(C)OC(=O)OCCC

Isomeric SMILES

CCCOC(=O)OC(C)OP(=O)(COC(C)CN1C=NC2=C1N=CN=C2N)OC(C)OC(=O)OCCC

InChI

InChI=1S/C21H34N5O10P/c1-6-8-30-20(27)33-15(4)35-37(29,36-16(5)34-21(28)31-9-7-2)13-32-14(3)10-26-12-25-17-18(22)23-11-24-19(17)26/h11-12,14-16H,6-10,13H2,1-5H3,(H2,22,23,24)