Compound C18H22BrNO2

3-benzyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium bromide

CAS: 57543-08-5

Molecular Formula	`C18H22BrNO2`
Molecular Weight	364.3 g/mol
Topological Polar Surface Area	35.1 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	4
Exact Mass	363.0834
Heavy Atoms	22
Complexity	316.0

Chemical Identifiers

CAS Number	57543-08-5
SMILES	`COC1=C(C=C2C[NH2+]C(CC2=C1)CC3=CC=CC=C3)OC.[Br-]`
InChIKey	`HTQKMKGTTGLMKF-UHFFFAOYSA-N`

📖 Product Overview

Compound C18H22BrNO2 (CAS: 57543-08-5) is a chemical compound with molecular formula C18H22BrNO2 and molecular weight 364.3 g/mol. Its IUPAC systematic name is 3-benzyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium bromide. Topological Polar Surface Area 35.1 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 4 Exact Mass 363.0834 Heavy Atoms 22 Complexity 316.0 InChI Key: HTQKMKGTTGLMKF-UHFFFAOYSA-N. SMILES: COC1=C(C=C2C[NH2+]C(CC2=C1)CC3=CC=CC=C3)OC.[Br-].

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