bis[(E)-3-chloranylprop-2-enyl]-methyl-octadecyl-azanium

Systemtic Name: bis[(E)-3-chloranylprop-2-enyl]-methyl-octadecyl-azanium Openeye Name: bis[(E)-3-chloroallyl]-methyl-octadecyl-ammonium CAS Name: bis[(E)-3-chloroprop-2-enyl]-methyl-octadecylammonium IUPAC Name: bis[(E)-3-chloroprop-2-enyl]-methyl-octadecylazanium Traditional Name: bis[(E)-3-chloroallyl]-methyl-stearyl-ammonium Formula: C25H48Cl2N+ MolecularWeight: 433.56132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(CC=CCl)CC=CCl

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C/C=C/Cl)(C/C=C/Cl)C

InChI

InChI=1S/C25H48Cl2N/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-28(2,24-19-21-26)25-20-22-27/h19-22H,3-18,23-25H2,1-2H3/q+1/b21-19+,22-20+