4-[2,3-bis(3,7,11,15-tetramethylhexadecoxy)propoxy-oxidanyl-phosphoryl]oxybutyl-trimethyl-azanium

Systemtic Name: 4-[2,3-bis(3,7,11,15-tetramethylhexadecoxy)propoxy-oxidanyl-phosphoryl]oxybutyl-trimethyl-azanium Openeye Name: 4-[2,3-bis(3,7,11,15-tetramethylhexadecoxy)propoxy-hydroxy-phosphoryl]oxybutyl-trimethyl-ammonium CAS Name: 4-[2,3-bis(3,7,11,15-tetramethylhexadecoxy)propoxy-hydroxyphosphoryl]oxybutyl-trimethylammonium IUPAC Name: 4-[2,3-bis(3,7,11,15-tetramethylhexadecoxy)propoxy-hydroxyphosphoryl]oxybutyl-trimethylazanium Traditional Name: 4-[2,3-bis(3,7,11,15-tetramethylhexadecoxy)propoxy-hydroxy-phosphoryl]oxybutyl-trimethyl-ammonium Formula: C50H105NO6P+ MolecularWeight: 847.345561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)CCCC(C)CCCC(C)CCOCC(COP(=O)(O)OCCCC[N+](C)(C)C)OCCC(C)CCCC(C)CCCC(C)CCCC(C)C

Isomeric SMILES

CC(C)CCCC(C)CCCC(C)CCCC(C)CCOCC(COP(=O)(O)OCCCC[N+](C)(C)C)OCCC(C)CCCC(C)CCCC(C)CCCC(C)C

InChI

InChI=1S/C50H104NO6P/c1-42(2)22-16-24-44(5)26-18-28-46(7)30-20-32-48(9)34-38-54-40-50(41-57-58(52,53)56-37-15-14-36-51(11,12)13)55-39-35-49(10)33-21-31-47(8)29-19-27-45(6)25-17-23-43(3)4/h42-50H,14-41H2,1-13H3/p+1