[(E)-3-chloranylprop-2-enyl]-di(heptadecan-2-yl)azanium chloride

Systemtic Name: [(E)-3-chloranylprop-2-enyl]-di(heptadecan-2-yl)azanium chloride Openeye Name: [(E)-3-chloroallyl]-bis(1-methylhexadecyl)ammonium chloride CAS Name: [(E)-3-chloroprop-2-enyl]-di(heptadecan-2-yl)ammonium chloride IUPAC Name: [(E)-3-chloroprop-2-enyl]-di(heptadecan-2-yl)azanium chloride Traditional Name: [(E)-3-chloroallyl]-bis(1-methylhexadecyl)ammonium chloride Formula: C37H75Cl2N MolecularWeight: 604.9041

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C)[NH+](CC=CCl)C(C)CCCCCCCCCCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(C)[NH+](C/C=C/Cl)C(C)CCCCCCCCCCCCCCC.[Cl-]

InChI

InChI=1S/C37H74ClN.ClH/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-32-36(3)39(35-31-34-38)37(4)33-30-28-26-24-22-20-18-16-14-12-10-8-6-2;/h31,34,36-37H,5-30,32-33,35H2,1-4H3;1H/b34-31+;