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4,5-bis[(E)-octadec-9-enoxy]pentan-2-yl-diethyl-azanium

4,5-bis[(E)-octadec-9-enoxy]pentan-2-yl-diethyl-azanium

Systemtic Name:4,5-bis[(E)-octadec-9-enoxy]pentan-2-yl-diethyl-azanium
Openeye Name:diethyl-[1-methyl-3,4-bis[(E)-octadec-9-enoxy]butyl]ammonium
CAS Name:4,5-bis[(E)-octadec-9-enoxy]pentan-2-yl-diethylammonium
IUPAC Name:4,5-bis[(E)-octadec-9-enoxy]pentan-2-yl-diethylazanium
Traditional Name:diethyl-[1-methyl-3,4-bis[(E)-octadec-9-enoxy]butyl]ammonium
Formula: C45H90NO2+
MolecularWeight: 677.2016
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOCC(CC(C)[NH+](CC)CC)OCCCCCCCCC=CCCCCCCCC


Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOCC(CC(C)[NH+](CC)CC)OCCCCCCCC/C=C/CCCCCCCC


InChI

InChI=1S/C45H89NO2/c1-6-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-47-43-45(42-44(5)46(8-3)9-4)48-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-7-2/h22-25,44-45H,6-21,26-43H2,1-5H3/p+1/b24-22+,25-23+


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