Compound C22H22ClNO3

2-benzyl-1-(2-hydroxyphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-4,6-diol chloride

CAS: 93202-98-3

Molecular Formula	`C22H22ClNO3`
Molecular Weight	383.9 g/mol
Topological Polar Surface Area	65.1 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	4
Rotatable Bonds	3
Exact Mass	383.1288
Heavy Atoms	27
Complexity	453.0

Chemical Identifiers

CAS Number	93202-98-3
SMILES	`C1C(C2=C(C=CC(=C2)O)C([NH+]1CC3=CC=CC=C3)C4=CC=CC=C4O)O.[Cl-]`
InChIKey	`IUNJTJVVPZTTGH-UHFFFAOYSA-N`

📖 Product Overview

Compound C22H22ClNO3 (CAS: 93202-98-3) is a chemical compound with molecular formula C22H22ClNO3 and molecular weight 383.9 g/mol. Its IUPAC systematic name is 2-benzyl-1-(2-hydroxyphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-4,6-diol chloride. Topological Polar Surface Area 65.1 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 4 Rotatable Bonds 3 Exact Mass 383.1288 Heavy Atoms 27 Complexity 453.0 InChI Key: IUNJTJVVPZTTGH-UHFFFAOYSA-N. SMILES: C1C(C2=C(C=CC(=C2)O)C([NH+]1CC3=CC=CC=C3)C4=CC=CC=C4O)O.[Cl-].

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