9-[[4-[1-(acridin-9-ylmethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]acridine dibromide

Systemtic Name: 9-[[4-[1-(acridin-9-ylmethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]acridine dibromide Openeye Name: 9-[[4-[1-(acridin-9-ylmethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]acridine dibromide CAS Name: 9-[[4-[1-(9-acridinylmethyl)-4-pyridin-1-iumyl]-1-pyridin-1-iumyl]methyl]acridine dibromide IUPAC Name: 9-[[4-[1-(acridin-9-ylmethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]acridine dibromide Traditional Name: 9-[[4-[1-(acridin-9-ylmethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]acridine dibromide Formula: C38H28Br2N4 MolecularWeight: 700.46372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)C[N+]4=CC=C(C=C4)C5=CC=[N+](C=C5)CC6=C7C=CC=CC7=NC8=CC=CC=C86.[Br-].[Br-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)C[N+]4=CC=C(C=C4)C5=CC=[N+](C=C5)CC6=C7C=CC=CC7=NC8=CC=CC=C86.[Br-].[Br-]

InChI

InChI=1S/C38H28N4.2BrH/c1-5-13-35-29(9-1)33(30-10-2-6-14-36(30)39-35)25-41-21-17-27(18-22-41)28-19-23-42(24-20-28)26-34-31-11-3-7-15-37(31)40-38-16-8-4-12-32(34)38;;/h1-24H,25-26H2;2*1H/q+2;;/p-2