1-[(Z)-2-bromanyl-4-pyridin-1-ium-1-yl-but-2-enyl]pyridin-1-ium dichloride

Systemtic Name: 1-[(Z)-2-bromanyl-4-pyridin-1-ium-1-yl-but-2-enyl]pyridin-1-ium dichloride Openeye Name: 1-[(Z)-2-bromo-4-pyridin-1-ium-1-yl-but-2-enyl]pyridin-1-ium dichloride CAS Name: 1-[(Z)-2-bromo-4-(1-pyridin-1-iumyl)but-2-enyl]pyridin-1-ium dichloride IUPAC Name: 1-[(Z)-2-bromo-4-pyridin-1-ium-1-ylbut-2-enyl]pyridin-1-ium dichloride Traditional Name: 1-[(Z)-2-bromo-4-pyridin-1-ium-1-yl-but-2-enyl]pyridin-1-ium dichloride Formula: C14H15BrCl2N2 MolecularWeight: 362.0923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC=C(C[N+]2=CC=CC=C2)Br.[Cl-].[Cl-]

Isomeric SMILES

C1=CC=[N+](C=C1)C/C=C(/C[N+]2=CC=CC=C2)\Br.[Cl-].[Cl-]

InChI

InChI=1S/C14H15BrN2.2ClH/c15-14(13-17-10-5-2-6-11-17)7-12-16-8-3-1-4-9-16;;/h1-11H,12-13H2;2*1H/q+2;;/p-2/b14-7-;;