Compound C20H22ClNO4

[3-(morpholin-4-ium-4-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-phenylmethanone chloride

CAS: 100022-13-7

Molecular Formula	`C20H22ClNO4`
Molecular Weight	375.8 g/mol
Topological Polar Surface Area	49.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	375.12375
Heavy Atoms	26
Complexity	445.0

Chemical Identifiers

CAS Number	100022-13-7
SMILES	`C1COCC[NH+]1CC2COC3=C(O2)C=C(C=C3)C(=O)C4=CC=CC=C4.[Cl-]`
InChIKey	`XMDJIURQLSRTIO-UHFFFAOYSA-N`

📖 Product Overview

Compound C20H22ClNO4 (CAS: 100022-13-7) is a chemical compound with molecular formula C20H22ClNO4 and molecular weight 375.8 g/mol. Its IUPAC systematic name is [3-(morpholin-4-ium-4-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-phenylmethanone chloride. Topological Polar Surface Area 49.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 4 Exact Mass 375.12375 Heavy Atoms 26 Complexity 445.0 InChI Key: XMDJIURQLSRTIO-UHFFFAOYSA-N. SMILES: C1COCC[NH+]1CC2COC3=C(O2)C=C(C=C3)C(=O)C4=CC=CC=C4.[Cl-].

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