Compound C22H27ClN2O

3-[(1-benzylpiperidin-1-ium-4-yl)methyl]-5-methoxy-1H-indole chloride

CAS: 3515-59-1

Molecular Formula	`C22H27ClN2O`
Molecular Weight	370.9 g/mol
Topological Polar Surface Area	29.5 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	2
Rotatable Bonds	5
Exact Mass	370.18118
Heavy Atoms	26
Complexity	401.0

Chemical Identifiers

CAS Number	3515-59-1
SMILES	`COC1=CC2=C(C=C1)NC=C2CC3CC[NH+](CC3)CC4=CC=CC=C4.[Cl-]`
InChIKey	`DXNPDPHLCZRDFG-UHFFFAOYSA-N`

📖 Product Overview

Compound C22H27ClN2O (CAS: 3515-59-1) is a chemical compound with molecular formula C22H27ClN2O and molecular weight 370.9 g/mol. Its IUPAC systematic name is 3-[(1-benzylpiperidin-1-ium-4-yl)methyl]-5-methoxy-1H-indole chloride. Topological Polar Surface Area 29.5 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 2 Rotatable Bonds 5 Exact Mass 370.18118 Heavy Atoms 26 Complexity 401.0 InChI Key: DXNPDPHLCZRDFG-UHFFFAOYSA-N. SMILES: COC1=CC2=C(C=C1)NC=C2CC3CC[NH+](CC3)CC4=CC=CC=C4.[Cl-].

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