N,N'-bis[4-[(1-ethylpyridin-1-ium-4-yl)amino]phenyl]octanediamide dibromide

Systemtic Name: N,N'-bis[4-[(1-ethylpyridin-1-ium-4-yl)amino]phenyl]octanediamide dibromide Openeye Name: N,N'-bis[4-[(1-ethylpyridin-1-ium-4-yl)amino]phenyl]octanediamide dibromide CAS Name: N,N'-bis[4-[(1-ethyl-4-pyridin-1-iumyl)amino]phenyl]octanediamide dibromide IUPAC Name: N,N'-bis[4-[(1-ethylpyridin-1-ium-4-yl)amino]phenyl]octanediamide dibromide Traditional Name: N,N'-bis[4-[(1-ethylpyridin-1-ium-4-yl)amino]phenyl]suberamide dibromide Formula: C34H42Br2N6O2 MolecularWeight: 726.54428

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)CCCCCCC(=O)NC3=CC=C(C=C3)NC4=CC=[N+](C=C4)CC.[Br-].[Br-]

Isomeric SMILES

CC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)CCCCCCC(=O)NC3=CC=C(C=C3)NC4=CC=[N+](C=C4)CC.[Br-].[Br-]

InChI

InChI=1S/C34H40N6O2.2BrH/c1-3-39-23-19-31(20-24-39)35-27-11-15-29(16-12-27)37-33(41)9-7-5-6-8-10-34(42)38-30-17-13-28(14-18-30)36-32-21-25-40(4-2)26-22-32;;/h11-26H,3-10H2,1-2H3,(H2,37,38,41,42);2*1H