6-[dimethyl(6-pyren-1-ylhexyl)azaniumyl]hexyl-dodecyl-dimethyl-azanium

Systemtic Name: 6-[dimethyl(6-pyren-1-ylhexyl)azaniumyl]hexyl-dodecyl-dimethyl-azanium Openeye Name: 6-[dimethyl(6-pyren-1-ylhexyl)ammonio]hexyl-dodecyl-dimethyl-ammonium CAS Name: 6-[dimethyl-[6-(1-pyrenyl)hexyl]ammonio]hexyl-dodecyl-dimethylammonium IUPAC Name: 6-[dimethyl(6-pyren-1-ylhexyl)azaniumyl]hexyl-dodecyl-dimethylazanium Traditional Name: 6-[dimethyl(6-pyren-1-ylhexyl)ammonio]hexyl-lauryl-dimethyl-ammonium Formula: C44H70N2+2 MolecularWeight: 627.04

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(C)CCCCCC[N+](C)(C)CCCCCCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)CCCCCC[N+](C)(C)CCCCCCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

InChI

InChI=1S/C44H70N2/c1-6-7-8-9-10-11-12-13-15-20-34-45(2,3)36-22-17-18-23-37-46(4,5)35-21-16-14-19-25-38-28-29-41-31-30-39-26-24-27-40-32-33-42(38)44(41)43(39)40/h24,26-33H,6-23,25,34-37H2,1-5H3/q+2