1-hexyl-2-[(Z)-2-phenyl-1-piperidin-1-yl-ethenyl]pyridin-1-ium bromide

Systemtic Name: 1-hexyl-2-[(Z)-2-phenyl-1-piperidin-1-yl-ethenyl]pyridin-1-ium bromide Openeye Name: 1-hexyl-2-[(Z)-2-phenyl-1-(1-piperidyl)vinyl]pyridin-1-ium bromide CAS Name: 1-hexyl-2-[(Z)-2-phenyl-1-(1-piperidinyl)ethenyl]pyridin-1-ium bromide IUPAC Name: 1-hexyl-2-[(Z)-2-phenyl-1-piperidin-1-ylethenyl]pyridin-1-ium bromide Traditional Name: 1-hexyl-2-[(Z)-2-phenyl-1-piperidino-vinyl]pyridin-1-ium bromide Formula: C24H33BrN2 MolecularWeight: 429.43622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+]1=CC=CC=C1C(=CC2=CC=CC=C2)N3CCCCC3.[Br-]

Isomeric SMILES

CCCCCC[N+]1=CC=CC=C1/C(=C/C2=CC=CC=C2)/N3CCCCC3.[Br-]

InChI

InChI=1S/C24H33N2.BrH/c1-2-3-4-10-17-25-20-13-9-16-23(25)24(26-18-11-6-12-19-26)21-22-14-7-5-8-15-22;/h5,7-9,13-16,20-21H,2-4,6,10-12,17-19H2,1H3;1H/q+1;/p-1/b24-21-;