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

Systemtic Name: N,N'-bis[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]heptanediamide dibromide Openeye Name: N,N'-bis[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]heptanediamide dibromide CAS Name: N,N'-bis[4-[(1-methyl-4-pyridin-1-iumyl)amino]phenyl]heptanediamide dibromide IUPAC Name: N,N'-bis[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]heptanediamide dibromide Traditional Name: N,N'-bis[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]pimelamide dibromide Formula: C31H36Br2N6O2 MolecularWeight: 684.46454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H34N6O2.2BrH/c1-36-20-16-28(17-21-36)32-24-8-12-26(13-9-24)34-30(38)6-4-3-5-7-31(39)35-27-14-10-25(11-15-27)33-29-18-22-37(2)23-19-29;;/h8-23H,3-7H2,1-2H3,(H2,34,35,38,39);2*1H