N-[[2,6-bis(chloranyl)phenyl]methoxy]-1-(1-propylpyridin-1-ium-4-yl)methanimine bromide

Systemtic Name: N-[[2,6-bis(chloranyl)phenyl]methoxy]-1-(1-propylpyridin-1-ium-4-yl)methanimine bromide Openeye Name: N-[(2,6-dichlorophenyl)methoxy]-1-(1-propylpyridin-1-ium-4-yl)methanimine bromide CAS Name: N-[(2,6-dichlorophenyl)methoxy]-1-(1-propyl-4-pyridin-1-iumyl)methanimine bromide IUPAC Name: N-[(2,6-dichlorophenyl)methoxy]-1-(1-propylpyridin-1-ium-4-yl)methanimine bromide Traditional Name: (E)-(2,6-dichlorobenzyl)oxy-[(1-propylpyridin-1-ium-4-yl)methylene]amine bromide Formula: C16H17BrCl2N2O MolecularWeight: 404.12898

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=CC=C(C=C1)C=NOCC2=C(C=CC=C2Cl)Cl.[Br-]

Isomeric SMILES

CCC[N+]1=CC=C(C=C1)/C=N/OCC2=C(C=CC=C2Cl)Cl.[Br-]

InChI

InChI=1S/C16H17Cl2N2O.BrH/c1-2-8-20-9-6-13(7-10-20)11-19-21-12-14-15(17)4-3-5-16(14)18;/h3-7,9-11H,2,8,12H2,1H3;1H/q+1;/p-1/b19-11+;