Compound C21H25I2NO4

1-[(2-iodo-4,5-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-2-ium iodide

CAS: 74411-75-9

Molecular Formula	`C21H25I2NO4`
Molecular Weight	609.2 g/mol
Topological Polar Surface Area	39.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	608.9873
Heavy Atoms	28
Complexity	528.0

Chemical Identifiers

CAS Number	74411-75-9
SMILES	`C[N+]1=C(C2=CC(=C(C=C2CC1)OC)OC)CC3=CC(=C(C=C3I)OC)OC.[I-]`
InChIKey	`TYNKTOOIWXJYQM-UHFFFAOYSA-M`

📖 Product Overview

Compound C21H25I2NO4 (CAS: 74411-75-9) is a chemical compound with molecular formula C21H25I2NO4 and molecular weight 609.2 g/mol. Its IUPAC systematic name is 1-[(2-iodo-4,5-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-2-ium iodide. Topological Polar Surface Area 39.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 6 Exact Mass 608.9873 Heavy Atoms 28 Complexity 528.0 InChI Key: TYNKTOOIWXJYQM-UHFFFAOYSA-M. SMILES: C[N+]1=C(C2=CC(=C(C=C2CC1)OC)OC)CC3=CC(=C(C=C3I)OC)OC.[I-].

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