N,N-diethyl-4-[(E)-2-(5-ethyl-1-propyl-pyridin-1-ium-2-yl)ethenyl]aniline bromide

Systemtic Name: N,N-diethyl-4-[(E)-2-(5-ethyl-1-propyl-pyridin-1-ium-2-yl)ethenyl]aniline bromide Openeye Name: N,N-diethyl-4-[(E)-2-(5-ethyl-1-propyl-pyridin-1-ium-2-yl)vinyl]aniline bromide CAS Name: N,N-diethyl-4-[(E)-2-(5-ethyl-1-propyl-2-pyridin-1-iumyl)ethenyl]aniline bromide IUPAC Name: N,N-diethyl-4-[(E)-2-(5-ethyl-1-propylpyridin-1-ium-2-yl)ethenyl]aniline bromide Traditional Name: diethyl-[4-[(E)-2-(5-ethyl-1-propyl-pyridin-1-ium-2-yl)vinyl]phenyl]amine bromide Formula: C22H31BrN2 MolecularWeight: 403.39894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31N2.BrH/c1-5-17-24-18-19(6-2)9-13-22(24)16-12-20-10-14-21(15-11-20)23(7-3)8-4;/h9-16,18H,5-8,17H2,1-4H3;1H/q+1;/p-1