3,3-bis[(E)-octadec-9-enoxy]butyl-dimethyl-azanium

Systemtic Name: 3,3-bis[(E)-octadec-9-enoxy]butyl-dimethyl-azanium Openeye Name: 3,3-bis[(E)-octadec-9-enoxy]butyl-dimethyl-ammonium CAS Name: 3,3-bis[(E)-octadec-9-enoxy]butyl-dimethylammonium IUPAC Name: 3,3-bis[(E)-octadec-9-enoxy]butyl-dimethylazanium Traditional Name: 3,3-bis[(E)-octadec-9-enoxy]butyl-dimethyl-ammonium Formula: C42H84NO2+ MolecularWeight: 635.12186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C42H83NO2/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-40-44-42(3,38-39-43(4)5)45-41-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23H,6-19,24-41H2,1-5H3/p+1/b22-20+,23-21+