Compound C19H19BrClNO3

4-[(4-chlorophenyl)methyl]-6,7,8-trimethoxyisoquinolin-2-ium bromide

CAS: 61189-97-7

Molecular Formula	`C19H19BrClNO3`
Molecular Weight	424.7 g/mol
Topological Polar Surface Area	41.8 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	423.02368
Heavy Atoms	25
Complexity	389.0

Chemical Identifiers

CAS Number	61189-97-7
SMILES	`COC1=C(C(=C2C=[NH+]C=C(C2=C1)CC3=CC=C(C=C3)Cl)OC)OC.[Br-]`
InChIKey	`GXXOQDZFIZORAO-UHFFFAOYSA-N`

📖 Product Overview

Compound C19H19BrClNO3 (CAS: 61189-97-7) is a chemical compound with molecular formula C19H19BrClNO3 and molecular weight 424.7 g/mol. Its IUPAC systematic name is 4-[(4-chlorophenyl)methyl]-6,7,8-trimethoxyisoquinolin-2-ium bromide. Topological Polar Surface Area 41.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 5 Exact Mass 423.02368 Heavy Atoms 25 Complexity 389.0 InChI Key: GXXOQDZFIZORAO-UHFFFAOYSA-N. SMILES: COC1=C(C(=C2C=[NH+]C=C(C2=C1)CC3=CC=C(C=C3)Cl)OC)OC.[Br-].

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