1-dodecyl-N-[3-[(1-dodecylpyridin-1-ium-3-yl)carbonylamino]phenyl]pyridin-1-ium-3-carboxamide dibromide

Systemtic Name: 1-dodecyl-N-[3-[(1-dodecylpyridin-1-ium-3-yl)carbonylamino]phenyl]pyridin-1-ium-3-carboxamide dibromide Openeye Name: 1-dodecyl-N-[3-[(1-dodecylpyridin-1-ium-3-carbonyl)amino]phenyl]pyridin-1-ium-3-carboxamide dibromide CAS Name: 1-dodecyl-N-[3-[[(1-dodecyl-3-pyridin-1-iumyl)-oxomethyl]amino]phenyl]-3-pyridin-1-iumcarboxamide dibromide IUPAC Name: 1-dodecyl-N-[3-[(1-dodecylpyridin-1-ium-3-carbonyl)amino]phenyl]pyridin-1-ium-3-carboxamide dibromide Traditional Name: 1-lauryl-N-[3-[(1-laurylpyridin-1-ium-3-carbonyl)amino]phenyl]pyridin-1-ium-3-carboxamide dibromide Formula: C42H64Br2N4O2 MolecularWeight: 816.79116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+]1=CC=CC(=C1)C(=O)NC2=CC(=CC=C2)NC(=O)C3=C[N+](=CC=C3)CCCCCCCCCCCC.[Br-].[Br-]

Isomeric SMILES

CCCCCCCCCCCC[N+]1=CC=CC(=C1)C(=O)NC2=CC(=CC=C2)NC(=O)C3=C[N+](=CC=C3)CCCCCCCCCCCC.[Br-].[Br-]

InChI

InChI=1S/C42H62N4O2.2BrH/c1-3-5-7-9-11-13-15-17-19-21-30-45-32-24-26-37(35-45)41(47)43-39-28-23-29-40(34-39)44-42(48)38-27-25-33-46(36-38)31-22-20-18-16-14-12-10-8-6-4-2;;/h23-29,32-36H,3-22,30-31H2,1-2H3;2*1H