Compound C16H22ClNO3

2-[(3,4-dimethoxyphenyl)methyl]-1-azoniabicyclo[2.2.2]octan-3-one chloride

CAS: 103660-57-7

Molecular Formula	`C16H22ClNO3`
Molecular Weight	311.8 g/mol
Topological Polar Surface Area	40.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	4
Exact Mass	311.1288
Heavy Atoms	21
Complexity	352.0

Chemical Identifiers

CAS Number	103660-57-7
SMILES	`COC1=C(C=C(C=C1)CC2C(=O)C3CC[NH+]2CC3)OC.[Cl-]`
InChIKey	`KDYDWTPNMWTMDG-UHFFFAOYSA-N`

📖 Product Overview

Compound C16H22ClNO3 (CAS: 103660-57-7) is a chemical compound with molecular formula C16H22ClNO3 and molecular weight 311.8 g/mol. Its IUPAC systematic name is 2-[(3,4-dimethoxyphenyl)methyl]-1-azoniabicyclo[2.2.2]octan-3-one chloride. Topological Polar Surface Area 40.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 4 Exact Mass 311.1288 Heavy Atoms 21 Complexity 352.0 InChI Key: KDYDWTPNMWTMDG-UHFFFAOYSA-N. SMILES: COC1=C(C=C(C=C1)CC2C(=O)C3CC[NH+]2CC3)OC.[Cl-].

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