N-[(1E,3E)-4-(1-ethylquinolin-1-ium-4-yl)buta-1,3-dienyl]aniline bromide

Systemtic Name: N-[(1E,3E)-4-(1-ethylquinolin-1-ium-4-yl)buta-1,3-dienyl]aniline bromide Openeye Name: N-[(1E,3E)-4-(1-ethylquinolin-1-ium-4-yl)buta-1,3-dienyl]aniline bromide CAS Name: N-[(1E,3E)-4-(1-ethyl-4-quinolin-1-iumyl)buta-1,3-dienyl]aniline bromide IUPAC Name: N-[(1E,3E)-4-(1-ethylquinolin-1-ium-4-yl)buta-1,3-dienyl]aniline bromide Traditional Name: [(1E,3E)-4-(1-ethylquinolin-1-ium-4-yl)buta-1,3-dienyl]-phenyl-amine bromide Formula: C21H21BrN2 MolecularWeight: 381.30884

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=C(C2=CC=CC=C21)C=CC=CNC3=CC=CC=C3.[Br-]

Isomeric SMILES

CC[N+]1=CC=C(C2=CC=CC=C21)/C=C/C=C/NC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C21H20N2.BrH/c1-2-23-17-15-18(20-13-6-7-14-21(20)23)10-8-9-16-22-19-11-4-3-5-12-19;/h3-17H,2H2,1H3;1H