12-chloranylhexadecyl-hexadecyl-dimethyl-azanium

Systemtic Name: 12-chloranylhexadecyl-hexadecyl-dimethyl-azanium Openeye Name: 12-chlorohexadecyl-hexadecyl-dimethyl-ammonium CAS Name: 12-chlorohexadecyl-hexadecyl-dimethylammonium IUPAC Name: 12-chlorohexadecyl-hexadecyl-dimethylazanium Traditional Name: cetyl-(12-chlorohexadecyl)-dimethyl-ammonium Formula: C34H71ClN+ MolecularWeight: 529.38724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCC(CCCC)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCC(CCCC)Cl

InChI

InChI=1S/C34H71ClN/c1-5-7-9-10-11-12-13-14-15-16-19-22-25-28-32-36(3,4)33-29-26-23-20-17-18-21-24-27-31-34(35)30-8-6-2/h34H,5-33H2,1-4H3/q+1