1-[(5Z,7Z)-12-(3,5-dimethylpyridin-1-ium-1-yl)dodeca-5,7-dienyl]-3,5-dimethyl-pyridin-1-ium dibromide

Systemtic Name: 1-[(5Z,7Z)-12-(3,5-dimethylpyridin-1-ium-1-yl)dodeca-5,7-dienyl]-3,5-dimethyl-pyridin-1-ium dibromide Openeye Name: 1-[(5Z,7Z)-12-(3,5-dimethylpyridin-1-ium-1-yl)dodeca-5,7-dienyl]-3,5-dimethyl-pyridin-1-ium dibromide CAS Name: 1-[(5Z,7Z)-12-(3,5-dimethyl-1-pyridin-1-iumyl)dodeca-5,7-dienyl]-3,5-dimethylpyridin-1-ium dibromide IUPAC Name: 1-[(5Z,7Z)-12-(3,5-dimethylpyridin-1-ium-1-yl)dodeca-5,7-dienyl]-3,5-dimethylpyridin-1-ium dibromide Traditional Name: 1-[(5Z,7Z)-12-(3,5-dimethylpyridin-1-ium-1-yl)dodeca-5,7-dienyl]-3,5-dimethyl-pyridin-1-ium dibromide Formula: C26H38Br2N2 MolecularWeight: 538.40132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C[N+](=C1)CCCCC=CC=CCCCC[N+]2=CC(=CC(=C2)C)C)C.[Br-].[Br-]

Isomeric SMILES

CC1=CC(=C[N+](=C1)CCCC/C=C\C=C/CCCC[N+]2=CC(=CC(=C2)C)C)C.[Br-].[Br-]

InChI

InChI=1S/C26H38N2.2BrH/c1-23-17-24(2)20-27(19-23)15-13-11-9-7-5-6-8-10-12-14-16-28-21-25(3)18-26(4)22-28;;/h5-8,17-22H,9-16H2,1-4H3;2*1H/q+2;;/p-2/b7-5-,8-6-;;