ethyl-hexadecyl-dimethyl-azanium; 2,3,5,6-tetrakis(chloranyl)phenolate

Systemtic Name: ethyl-hexadecyl-dimethyl-azanium; 2,3,5,6-tetrakis(chloranyl)phenolate Openeye Name: ethyl-hexadecyl-dimethyl-ammonium; 2,3,5,6-tetrachlorophenolate CAS Name: ethyl-hexadecyl-dimethylammonium; 2,3,5,6-tetrachlorophenolate IUPAC Name: ethyl-hexadecyl-dimethylazanium; 2,3,5,6-tetrachlorophenolate Traditional Name: cetyl-ethyl-dimethyl-ammonium; 2,3,5,6-tetrachlorophenolate Formula: C26H45Cl4NO MolecularWeight: 529.4536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CC.C1=C(C(=C(C(=C1Cl)Cl)[O-])Cl)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CC.C1=C(C(=C(C(=C1Cl)Cl)[O-])Cl)Cl

InChI

InChI=1S/C20H44N.C6H2Cl4O/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(3,4)6-2;7-2-1-3(8)5(10)6(11)4(2)9/h5-20H2,1-4H3;1,11H/q+1;/p-1