2,3-bis(12-imidazol-1-yldodecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: 2,3-bis(12-imidazol-1-yldodecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: 2,3-bis(12-imidazol-1-yldodecanoyloxy)propyl 2-(trimethylammonio)ethyl phosphate CAS Name: 2,3-bis[12-(1-imidazolyl)-1-oxododecoxy]propyl 2-(trimethylammonio)ethyl phosphate IUPAC Name: 2,3-bis(12-imidazol-1-yldodecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: 2,3-bis(12-imidazol-1-yldodecanoyloxy)propyl 2-(trimethylammonio)ethyl phosphate Formula: C38H68N5O8P MolecularWeight: 753.948981

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOP(=O)([O-])OCC(COC(=O)CCCCCCCCCCCN1C=CN=C1)OC(=O)CCCCCCCCCCCN2C=CN=C2

Isomeric SMILES

C[N+](C)(C)CCOP(=O)([O-])OCC(COC(=O)CCCCCCCCCCCN1C=CN=C1)OC(=O)CCCCCCCCCCCN2C=CN=C2

InChI

InChI=1S/C38H68N5O8P/c1-43(2,3)30-31-49-52(46,47)50-33-36(51-38(45)23-19-15-11-7-5-9-13-17-21-27-42-29-25-40-35-42)32-48-37(44)22-18-14-10-6-4-8-12-16-20-26-41-28-24-39-34-41/h24-25,28-29,34-36H,4-23,26-27,30-33H2,1-3H3