3-[[2,6-bis(methylamino)purin-9-yl]-oxidanyl-methoxy]propyl [(E)-dec-8-enyl] carbonate

Systemtic Name: 3-[[2,6-bis(methylamino)purin-9-yl]-oxidanyl-methoxy]propyl [(E)-dec-8-enyl] carbonate Openeye Name: 3-[[2,6-bis(methylamino)purin-9-yl]-hydroxy-methoxy]propyl [(E)-dec-8-enyl] carbonate CAS Name: carbonic acid 3-[[2,6-bis(methylamino)-9-purinyl]-hydroxymethoxy]propyl [(E)-dec-8-enyl] ester IUPAC Name: 3-[[2,6-bis(methylamino)purin-9-yl]-hydroxymethoxy]propyl [(E)-dec-8-enyl] carbonate Traditional Name: carbonic acid 3-[[2,6-bis(methylamino)purin-9-yl]-hydroxy-methoxy]propyl [(E)-dec-8-enyl] ester Formula: C22H36N6O5 MolecularWeight: 464.55844

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCCCCCCCOC(=O)OCCCOC(N1C=NC2=C1N=C(N=C2NC)NC)O

Isomeric SMILES

C/C=C/CCCCCCCOC(=O)OCCCOC(N1C=NC2=C1N=C(N=C2NC)NC)O

InChI

InChI=1S/C22H36N6O5/c1-4-5-6-7-8-9-10-11-13-32-22(30)33-15-12-14-31-21(29)28-16-25-17-18(23-2)26-20(24-3)27-19(17)28/h4-5,16,21,29H,6-15H2,1-3H3,(H2,23,24,26,27)/b5-4+