Compound C20H22BrNO4

4-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinolin-2-ium bromide

CAS: 32871-94-6

Molecular Formula	`C20H22BrNO4`
Molecular Weight	420.3 g/mol
Topological Polar Surface Area	51.1 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	419.0732
Heavy Atoms	26
Complexity	407.0

Chemical Identifiers

CAS Number	32871-94-6
SMILES	`COC1=C(C=C(C=C1)CC2=C[NH+]=CC3=CC(=C(C=C32)OC)OC)OC.[Br-]`
InChIKey	`NSWASABLHWBNRH-UHFFFAOYSA-N`

📖 Product Overview

Compound C20H22BrNO4 (CAS: 32871-94-6) is a chemical compound with molecular formula C20H22BrNO4 and molecular weight 420.3 g/mol. Its IUPAC systematic name is 4-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinolin-2-ium bromide. Topological Polar Surface Area 51.1 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 6 Exact Mass 419.0732 Heavy Atoms 26 Complexity 407.0 InChI Key: NSWASABLHWBNRH-UHFFFAOYSA-N. SMILES: COC1=C(C=C(C=C1)CC2=C[NH+]=CC3=CC(=C(C=C32)OC)OC)OC.[Br-].

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