[(2R)-2,3-bis[(Z)-hexadec-11-enoxy]propyl]-trimethyl-azanium iodide

Systemtic Name: [(2R)-2,3-bis[(Z)-hexadec-11-enoxy]propyl]-trimethyl-azanium iodide Openeye Name: [(2R)-2,3-bis[(Z)-hexadec-11-enoxy]propyl]-trimethyl-ammonium iodide CAS Name: [(2R)-2,3-bis[(Z)-hexadec-11-enoxy]propyl]-trimethylammonium iodide IUPAC Name: [(2R)-2,3-bis[(Z)-hexadec-11-enoxy]propyl]-trimethylazanium iodide Traditional Name: [(2R)-2,3-bis[(Z)-hexadec-11-enoxy]propyl]-trimethyl-ammonium iodide Formula: C38H76INO2 MolecularWeight: 705.92001

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CCCCCCCCCCCOCC(C[N+](C)(C)C)OCCCCCCCCCCC=CCCCC.[I-]

Isomeric SMILES

CCCC/C=C\CCCCCCCCCCOC[C@@H](C[N+](C)(C)C)OCCCCCCCCCC/C=C\CCCC.[I-]

InChI

InChI=1S/C38H76NO2.HI/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-40-37-38(36-39(3,4)5)41-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2;/h12-15,38H,6-11,16-37H2,1-5H3;1H/q+1;/p-1/b14-12-,15-13-;/t38-;/m1./s1