[1-(2,4-dichlorophenyl)-2-phenyl-ethyl]-dodecyl-dimethyl-azanium

Systemtic Name: [1-(2,4-dichlorophenyl)-2-phenyl-ethyl]-dodecyl-dimethyl-azanium Openeye Name: [1-(2,4-dichlorophenyl)-2-phenyl-ethyl]-dodecyl-dimethyl-ammonium CAS Name: [1-(2,4-dichlorophenyl)-2-phenylethyl]-dodecyl-dimethylammonium IUPAC Name: [1-(2,4-dichlorophenyl)-2-phenylethyl]-dodecyl-dimethylazanium Traditional Name: [1-(2,4-dichlorophenyl)-2-phenyl-ethyl]-lauryl-dimethyl-ammonium Formula: C28H42Cl2N+ MolecularWeight: 463.54578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(C)C(CC1=CC=CC=C1)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)C(CC1=CC=CC=C1)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C28H42Cl2N/c1-4-5-6-7-8-9-10-11-12-16-21-31(2,3)28(22-24-17-14-13-15-18-24)26-20-19-25(29)23-27(26)30/h13-15,17-20,23,28H,4-12,16,21-22H2,1-3H3/q+1