N,N-dihexyl-4-[(E)-2-(1-hexylpyridin-1-ium-4-yl)ethenyl]aniline bromide

Systemtic Name: N,N-dihexyl-4-[(E)-2-(1-hexylpyridin-1-ium-4-yl)ethenyl]aniline bromide Openeye Name: N,N-dihexyl-4-[(E)-2-(1-hexylpyridin-1-ium-4-yl)vinyl]aniline bromide CAS Name: N,N-dihexyl-4-[(E)-2-(1-hexyl-4-pyridin-1-iumyl)ethenyl]aniline bromide IUPAC Name: N,N-dihexyl-4-[(E)-2-(1-hexylpyridin-1-ium-4-yl)ethenyl]aniline bromide Traditional Name: dihexyl-[4-[(E)-2-(1-hexylpyridin-1-ium-4-yl)vinyl]phenyl]amine bromide Formula: C31H49BrN2 MolecularWeight: 529.63816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+]1=CC=C(C=C1)C=CC2=CC=C(C=C2)N(CCCCCC)CCCCCC.[Br-]

Isomeric SMILES

CCCCCC[N+]1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)N(CCCCCC)CCCCCC.[Br-]

InChI

InChI=1S/C31H49N2.BrH/c1-4-7-10-13-24-32-27-22-30(23-28-32)17-16-29-18-20-31(21-19-29)33(25-14-11-8-5-2)26-15-12-9-6-3;/h16-23,27-28H,4-15,24-26H2,1-3H3;1H/q+1;/p-1