2-[5-[3-(5-isoquinolin-2-ium-2-ylpentyl)phenyl]pentyl]isoquinolin-2-ium

Systemtic Name: 2-[5-[3-(5-isoquinolin-2-ium-2-ylpentyl)phenyl]pentyl]isoquinolin-2-ium Openeye Name: 2-[5-[3-(5-isoquinolin-2-ium-2-ylpentyl)phenyl]pentyl]isoquinolin-2-ium CAS Name: 2-[5-[3-[5-(2-isoquinolin-2-iumyl)pentyl]phenyl]pentyl]isoquinolin-2-ium IUPAC Name: 2-[5-[3-(5-isoquinolin-2-ium-2-ylpentyl)phenyl]pentyl]isoquinolin-2-ium Traditional Name: 2-[5-[3-(5-isoquinolin-2-ium-2-ylpentyl)phenyl]pentyl]isoquinolin-2-ium Formula: C34H38N2+2 MolecularWeight: 474.67892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CCCCCC3=CC(=CC=C3)CCCCC[N+]4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CCCCCC3=CC(=CC=C3)CCCCC[N+]4=CC5=CC=CC=C5C=C4

InChI

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