(3-benzoyl-1-methylpiperidin-1-ium-3-yl) 4-aminobenzoate chloride

CAS: 31823-18-4

Molecular Formula	`C20H23ClN2O3`
Molecular Weight	374.9 g/mol
Topological Polar Surface Area	73.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	374.1397
Heavy Atoms	26
Complexity	481.0

Chemical Identifiers

CAS Number	31823-18-4
SMILES	`C[NH+]1CCCC(C1)(C(=O)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)N.[Cl-]`
InChIKey	`VETOIGICEIOTIS-UHFFFAOYSA-N`

📖 Product Overview

(3-benzoyl-1-methylpiperidin-1-ium-3-yl) 4-aminobenzoate chloride (CAS: 31823-18-4) is a chemical compound with molecular formula C20H23ClN2O3 and molecular weight 374.9 g/mol. Its IUPAC systematic name is (3-benzoyl-1-methylpiperidin-1-ium-3-yl) 4-aminobenzoate chloride. Topological Polar Surface Area 73.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 5 Exact Mass 374.1397 Heavy Atoms 26 Complexity 481.0 InChI Key: VETOIGICEIOTIS-UHFFFAOYSA-N. SMILES: C[NH+]1CCCC(C1)(C(=O)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)N.[Cl-].

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