DTXSID70996860

(1R)-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2,2-dimethyl-3,4-dihydro-1H-isoquinolin-2-ium-7-ol chloride

CAS: 75413-87-5

Molecular Formula	`C19H24ClNO3`
Molecular Weight	349.8 g/mol
Topological Polar Surface Area	49.7 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	3
Exact Mass	349.14447
Heavy Atoms	24
Complexity	392.0

Chemical Identifiers

CAS Number	75413-87-5
SMILES	`C[N+]1(CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)O)OC)C.[Cl-]`
InChIKey	`VPFXIJWKEYUDJZ-UNTBIKODSA-N`

📖 Product Overview

DTXSID70996860 (CAS: 75413-87-5) is a chemical compound with molecular formula C19H24ClNO3 and molecular weight 349.8 g/mol. Its IUPAC systematic name is (1R)-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2,2-dimethyl-3,4-dihydro-1H-isoquinolin-2-ium-7-ol chloride. Topological Polar Surface Area 49.7 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 3 Exact Mass 349.14447 Heavy Atoms 24 Complexity 392.0 InChI Key: VPFXIJWKEYUDJZ-UNTBIKODSA-N. SMILES: C[N+]1(CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)O)OC)C.[Cl-].

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