2,3-bis[(4-pyridin-4-ylpyridin-1-ium-1-yl)methyl]quinoxaline dibromide

Systemtic Name: 2,3-bis[(4-pyridin-4-ylpyridin-1-ium-1-yl)methyl]quinoxaline dibromide Openeye Name: 2,3-bis[[4-(4-pyridyl)pyridin-1-ium-1-yl]methyl]quinoxaline dibromide CAS Name: 2,3-bis[(4-pyridin-4-yl-1-pyridin-1-iumyl)methyl]quinoxaline dibromide IUPAC Name: 2,3-bis[(4-pyridin-4-ylpyridin-1-ium-1-yl)methyl]quinoxaline dibromide Traditional Name: 2,3-bis[[4-(4-pyridyl)pyridin-1-ium-1-yl]methyl]quinoxaline dibromide Formula: C30H24Br2N6 MolecularWeight: 628.35976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)C[N+]3=CC=C(C=C3)C4=CC=NC=C4)C[N+]5=CC=C(C=C5)C6=CC=NC=C6.[Br-].[Br-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)C[N+]3=CC=C(C=C3)C4=CC=NC=C4)C[N+]5=CC=C(C=C5)C6=CC=NC=C6.[Br-].[Br-]

InChI

InChI=1S/C30H24N6.2BrH/c1-2-4-28-27(3-1)33-29(21-35-17-9-25(10-18-35)23-5-13-31-14-6-23)30(34-28)22-36-19-11-26(12-20-36)24-7-15-32-16-8-24;;/h1-20H,21-22H2;2*1H/q+2;;/p-2