dibutyl-bis[(E)-hexadec-1-enyl]azanium chloride

Systemtic Name: dibutyl-bis[(E)-hexadec-1-enyl]azanium chloride Openeye Name: dibutyl-bis[(E)-hexadec-1-enyl]ammonium chloride CAS Name: dibutyl-bis[(E)-hexadec-1-enyl]ammonium chloride IUPAC Name: dibutyl-bis[(E)-hexadec-1-enyl]azanium chloride Traditional Name: dibutyl-bis[(E)-hexadec-1-enyl]ammonium chloride Formula: C40H80ClN MolecularWeight: 610.5229

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC=C[N+](CCCC)(CCCC)C=CCCCCCCCCCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCC/C=C/[N+](/C=C/CCCCCCCCCCCCCC)(CCCC)CCCC.[Cl-]

InChI

InChI=1S/C40H80N.ClH/c1-5-9-13-15-17-19-21-23-25-27-29-31-33-35-39-41(37-11-7-3,38-12-8-4)40-36-34-32-30-28-26-24-22-20-18-16-14-10-6-2;/h35-36,39-40H,5-34,37-38H2,1-4H3;1H/q+1;/p-1/b39-35+,40-36+;