N,N'-bis(1-decylpyridin-1-ium-4-yl)hexanediamide dibromide

Systemtic Name: N,N'-bis(1-decylpyridin-1-ium-4-yl)hexanediamide dibromide Openeye Name: N,N'-bis(1-decylpyridin-1-ium-4-yl)hexanediamide dibromide CAS Name: N,N'-bis(1-decyl-4-pyridin-1-iumyl)hexanediamide dibromide IUPAC Name: N,N'-bis(1-decylpyridin-1-ium-4-yl)hexanediamide dibromide Traditional Name: N,N'-bis(1-decylpyridin-1-ium-4-yl)adipamide dibromide Formula: C36H60Br2N4O2 MolecularWeight: 740.6952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H58N4O2.2BrH/c1-3-5-7-9-11-13-15-19-27-39-29-23-33(24-30-39)37-35(41)21-17-18-22-36(42)38-34-25-31-40(32-26-34)28-20-16-14-12-10-8-6-4-2;;/h23-26,29-32H,3-22,27-28H2,1-2H3;2*1H