Quinolinium, 1-ethyl-6-(p-((1-ethylquinolinium-6-yl)carbamoyl)hydrocinnamamido)-, di-p-toluenesulfonate

N-(1-ethylquinolin-1-ium-6-yl)-2-[4-[2-[(1-ethylquinolin-1-ium-6-yl)amino]-2-oxoethyl]phenyl]acetamide;bis(4-methylbenzenesulfonate)

CAS: 14120-93-5

Molecular Formula	`C46H46N4O8S2`
Molecular Weight	847.0 g/mol
Topological Polar Surface Area	197.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	8
Rotatable Bonds	8
Exact Mass	846.2757
Heavy Atoms	60
Complexity	910.0

Chemical Identifiers

CAS Number	14120-93-5
SMILES	`CC[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)CC3=CC=C(C=C3)CC(=O)NC4=CC5=C(C=C4)[N+](=CC=C5)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]`
InChIKey	`OHIMFGPUGASRQY-UHFFFAOYSA-N`

📖 Product Overview

Quinolinium, 1-ethyl-6-(p-((1-ethylquinolinium-6-yl)carbamoyl)hydrocinnamamido)-, di-p-toluenesulfonate (CAS: 14120-93-5) is a chemical compound with molecular formula C46H46N4O8S2 and molecular weight 847.0 g/mol. Its IUPAC systematic name is N-(1-ethylquinolin-1-ium-6-yl)-2-[4-[2-[(1-ethylquinolin-1-ium-6-yl)amino]-2-oxoethyl]phenyl]acetamide;bis(4-methylbenzenesulfonate). Topological Polar Surface Area 197.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 8 Rotatable Bonds 8 Exact Mass 846.2757 Heavy Atoms 60 Complexity 910.0 InChI Key: OHIMFGPUGASRQY-UHFFFAOYSA-N. SMILES: CC[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)CC3=CC=C(C=C3)CC(=O)NC4=CC5=C(C=C4)[N+](=CC=C5)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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