3-(2-methylpiperidin-1-ium-1-yl)propyl 4-(4-methoxyphenyl)benzoate chloride

CAS: 69766-24-1

Molecular Formula	`C23H30ClNO3`
Molecular Weight	403.9 g/mol
Topological Polar Surface Area	40.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	8
Exact Mass	403.1914
Heavy Atoms	28
Complexity	439.0

Chemical Identifiers

CAS Number	69766-24-1
SMILES	`CC1CCCC[NH+]1CCCOC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC.[Cl-]`
InChIKey	`TZYRJXZWCDZCNG-UHFFFAOYSA-N`

📖 Product Overview

3-(2-methylpiperidin-1-ium-1-yl)propyl 4-(4-methoxyphenyl)benzoate chloride (CAS: 69766-24-1) is a chemical compound with molecular formula C23H30ClNO3 and molecular weight 403.9 g/mol. Its IUPAC systematic name is 3-(2-methylpiperidin-1-ium-1-yl)propyl 4-(4-methoxyphenyl)benzoate chloride. Topological Polar Surface Area 40.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 8 Exact Mass 403.1914 Heavy Atoms 28 Complexity 439.0 InChI Key: TZYRJXZWCDZCNG-UHFFFAOYSA-N. SMILES: CC1CCCC[NH+]1CCCOC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC.[Cl-].

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