3-(2-bromophenyl)-5-(3-chlorophenyl)-1-ethyl-N,N-dimethyl-pyridin-1-ium-4-amine fluoride

Systemtic Name: 3-(2-bromophenyl)-5-(3-chlorophenyl)-1-ethyl-N,N-dimethyl-pyridin-1-ium-4-amine fluoride Openeye Name: 3-(2-bromophenyl)-5-(3-chlorophenyl)-1-ethyl-N,N-dimethyl-pyridin-1-ium-4-amine fluoride CAS Name: 3-(2-bromophenyl)-5-(3-chlorophenyl)-1-ethyl-N,N-dimethyl-4-pyridin-1-iumamine fluoride IUPAC Name: 3-(2-bromophenyl)-5-(3-chlorophenyl)-1-ethyl-N,N-dimethylpyridin-1-ium-4-amine fluoride Traditional Name: [3-(2-bromophenyl)-5-(3-chlorophenyl)-1-ethyl-pyridin-1-ium-4-yl]-dimethyl-amine fluoride Formula: C21H21BrClFN2 MolecularWeight: 435.760243

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC(=C(C(=C1)C2=CC(=CC=C2)Cl)N(C)C)C3=CC=CC=C3Br.[F-]

Isomeric SMILES

CC[N+]1=CC(=C(C(=C1)C2=CC(=CC=C2)Cl)N(C)C)C3=CC=CC=C3Br.[F-]

InChI

InChI=1S/C21H21BrClN2.FH/c1-4-25-13-18(15-8-7-9-16(23)12-15)21(24(2)3)19(14-25)17-10-5-6-11-20(17)22;/h5-14H,4H2,1-3H3;1H/q+1;/p-1