Compound C22H23ClN2O7

4-methoxy-6-(4-methoxy-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-6-yl)-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-ol chloride

CAS: 5584-82-7

Molecular Formula	`C22H23ClN2O7`
Molecular Weight	462.9 g/mol
Topological Polar Surface Area	81.9 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	9
Rotatable Bonds	3
Exact Mass	462.1194
Heavy Atoms	32
Complexity	707.0

Chemical Identifiers

CAS Number	5584-82-7
SMILES	`COC1=C2C=[N+](CCC2=CC3=C1OCO3)N4CCC5=CC6=C(C(=C5C4O)OC)OCO6.[Cl-]`
InChIKey	`LGUAZQBWNNOEBF-UHFFFAOYSA-M`

📖 Product Overview

Compound C22H23ClN2O7 (CAS: 5584-82-7) is a chemical compound with molecular formula C22H23ClN2O7 and molecular weight 462.9 g/mol. Its IUPAC systematic name is 4-methoxy-6-(4-methoxy-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-6-yl)-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-ol chloride. Topological Polar Surface Area 81.9 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 9 Rotatable Bonds 3 Exact Mass 462.1194 Heavy Atoms 32 Complexity 707.0 InChI Key: LGUAZQBWNNOEBF-UHFFFAOYSA-M. SMILES: COC1=C2C=[N+](CCC2=CC3=C1OCO3)N4CCC5=CC6=C(C(=C5C4O)OC)OCO6.[Cl-].

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