6-[2-[2-[1-(2,2-dimethoxypropoxy)-3-octadecoxy-propoxy]ethoxy]ethyl-dimethyl-azaniumyl]hexanoate

Systemtic Name: 6-[2-[2-[1-(2,2-dimethoxypropoxy)-3-octadecoxy-propoxy]ethoxy]ethyl-dimethyl-azaniumyl]hexanoate Openeye Name: 6-[2-[2-[1-(2,2-dimethoxypropoxy)-3-octadecoxy-propoxy]ethoxy]ethyl-dimethyl-ammonio]hexanoate CAS Name: 6-[2-[2-[1-(2,2-dimethoxypropoxy)-3-octadecoxypropoxy]ethoxy]ethyl-dimethylammonio]hexanoate IUPAC Name: 6-[2-[2-[1-(2,2-dimethoxypropoxy)-3-octadecoxypropoxy]ethoxy]ethyl-dimethylazaniumyl]hexanoate Traditional Name: 6-[2-[2-[1-(2,2-dimethoxypropoxy)-3-stearyloxy-propoxy]ethoxy]ethyl-dimethyl-ammonio]hexanoate Formula: C38H77NO8 MolecularWeight: 676.01988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCCC(OCCOCC[N+](C)(C)CCCCCC(=O)[O-])OCC(C)(OC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCCC(OCCOCC[N+](C)(C)CCCCCC(=O)[O-])OCC(C)(OC)OC

InChI

InChI=1S/C38H77NO8/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-30-44-31-27-37(47-35-38(2,42-5)43-6)46-34-33-45-32-29-39(3,4)28-24-22-23-26-36(40)41/h37H,7-35H2,1-6H3