2,3-bis(8-butyloctadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: 2,3-bis(8-butyloctadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: 2,3-bis(8-butyloctadecanoyloxy)propyl 2-(trimethylammonio)ethyl phosphate CAS Name: 2,3-bis(8-butyl-1-oxooctadecoxy)propyl 2-(trimethylammonio)ethyl phosphate IUPAC Name: 2,3-bis(8-butyloctadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: 2,3-bis(8-butyloctadecanoyloxy)propyl 2-(trimethylammonio)ethyl phosphate Formula: C52H104NO8P MolecularWeight: 902.357821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCC)CCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC(CCCC)CCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCC(CCCC)CCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC(CCCC)CCCCCCCCCC

InChI

InChI=1S/C52H104NO8P/c1-8-12-16-18-20-22-24-30-38-48(36-14-10-3)40-32-26-28-34-42-51(54)58-46-50(47-60-62(56,57)59-45-44-53(5,6)7)61-52(55)43-35-29-27-33-41-49(37-15-11-4)39-31-25-23-21-19-17-13-9-2/h48-50H,8-47H2,1-7H3