1-[5-[3-(5-quinolin-1-ium-1-ylpentyl)phenyl]pentyl]quinolin-1-ium dibromide

Systemtic Name: 1-[5-[3-(5-quinolin-1-ium-1-ylpentyl)phenyl]pentyl]quinolin-1-ium dibromide Openeye Name: 1-[5-[3-(5-quinolin-1-ium-1-ylpentyl)phenyl]pentyl]quinolin-1-ium dibromide CAS Name: 1-[5-[3-[5-(1-quinolin-1-iumyl)pentyl]phenyl]pentyl]quinolin-1-ium dibromide IUPAC Name: 1-[5-[3-(5-quinolin-1-ium-1-ylpentyl)phenyl]pentyl]quinolin-1-ium dibromide Traditional Name: 1-[5-[3-(5-quinolin-1-ium-1-ylpentyl)phenyl]pentyl]quinolin-1-ium dibromide Formula: C34H38Br2N2 MolecularWeight: 634.48692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=[N+]2CCCCCC3=CC(=CC=C3)CCCCC[N+]4=CC=CC5=CC=CC=C54.[Br-].[Br-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=[N+]2CCCCCC3=CC(=CC=C3)CCCCC[N+]4=CC=CC5=CC=CC=C54.[Br-].[Br-]

InChI

InChI=1S/C34H38N2.2BrH/c1(9-24-35-26-12-20-31-18-5-7-22-33(31)35)3-14-29-16-11-17-30(28-29)15-4-2-10-25-36-27-13-21-32-19-6-8-23-34(32)36;;/h5-8,11-13,16-23,26-28H,1-4,9-10,14-15,24-25H2;2*1H/q+2;;/p-2