Compound C19H27Cl3N2O

2-[(3-chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-5-ium-11-yl)oxy]propyl-dimethylazanium dichloride

CAS: 5231-44-7

Molecular Formula	`C19H27Cl3N2O`
Molecular Weight	405.8 g/mol
Topological Polar Surface Area	27.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	4
Exact Mass	404.1189
Heavy Atoms	25
Complexity	378.0

Chemical Identifiers

CAS Number	5231-44-7
SMILES	`CC(C[NH+](C)C)OC1=C2CCCCCC2=[NH+]C3=C1C=CC(=C3)Cl.[Cl-].[Cl-]`
InChIKey	`AXFZBZNCXQZMJT-UHFFFAOYSA-N`

📖 Product Overview

Compound C19H27Cl3N2O (CAS: 5231-44-7) is a chemical compound with molecular formula C19H27Cl3N2O and molecular weight 405.8 g/mol. Its IUPAC systematic name is 2-[(3-chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-5-ium-11-yl)oxy]propyl-dimethylazanium dichloride. Topological Polar Surface Area 27.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 3 Rotatable Bonds 4 Exact Mass 404.1189 Heavy Atoms 25 Complexity 378.0 InChI Key: AXFZBZNCXQZMJT-UHFFFAOYSA-N. SMILES: CC(C[NH+](C)C)OC1=C2CCCCCC2=[NH+]C3=C1C=CC(=C3)Cl.[Cl-].[Cl-].

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