Compound C21H26ClNO5

[3,5-dimethoxy-4-(2-morpholin-4-ium-4-ylethoxy)phenyl]-phenylmethanone chloride

CAS: 31848-00-7

Molecular Formula	`C21H26ClNO5`
Molecular Weight	407.9 g/mol
Topological Polar Surface Area	58.4 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	8
Exact Mass	407.14996
Heavy Atoms	28
Complexity	434.0

Chemical Identifiers

CAS Number	31848-00-7
SMILES	`COC1=CC(=CC(=C1OCC[NH+]2CCOCC2)OC)C(=O)C3=CC=CC=C3.[Cl-]`
InChIKey	`KTWVDKZZEZQALB-UHFFFAOYSA-N`

📖 Product Overview

Compound C21H26ClNO5 (CAS: 31848-00-7) is a chemical compound with molecular formula C21H26ClNO5 and molecular weight 407.9 g/mol. Its IUPAC systematic name is [3,5-dimethoxy-4-(2-morpholin-4-ium-4-ylethoxy)phenyl]-phenylmethanone chloride. Topological Polar Surface Area 58.4 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 8 Exact Mass 407.14996 Heavy Atoms 28 Complexity 434.0 InChI Key: KTWVDKZZEZQALB-UHFFFAOYSA-N. SMILES: COC1=CC(=CC(=C1OCC[NH+]2CCOCC2)OC)C(=O)C3=CC=CC=C3.[Cl-].

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