2-[2,3-bis(12-imidazol-1-yldodecanoyloxy)propoxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[2,3-bis(12-imidazol-1-yldodecanoyloxy)propoxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[2,3-bis(12-imidazol-1-yldodecanoyloxy)propoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[2,3-bis[12-(1-imidazolyl)-1-oxododecoxy]propoxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[2,3-bis(12-imidazol-1-yldodecanoyloxy)propoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[2,3-bis(12-imidazol-1-yldodecanoyloxy)propoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C38H69N5O8P+ MolecularWeight: 754.956921

Click to see the large picture

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/p+1