Compound C16H20ClNO2

7-methyl-5-(2-methylbutyl)-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride

CAS: 17105-22-5

Molecular Formula	`C16H20ClNO2`
Molecular Weight	293.79 g/mol
Topological Polar Surface Area	32.6 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	293.11826
Heavy Atoms	20
Complexity	309.0

Chemical Identifiers

CAS Number	17105-22-5
SMILES	`CCC(C)CC1=[NH+]C(=CC2=CC3=C(C=C21)OCO3)C.[Cl-]`
InChIKey	`WSYOFFJHJFJHRM-UHFFFAOYSA-N`

📖 Product Overview

Compound C16H20ClNO2 (CAS: 17105-22-5) is a chemical compound with molecular formula C16H20ClNO2 and molecular weight 293.79 g/mol. Its IUPAC systematic name is 7-methyl-5-(2-methylbutyl)-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride. Topological Polar Surface Area 32.6 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 3 Exact Mass 293.11826 Heavy Atoms 20 Complexity 309.0 InChI Key: WSYOFFJHJFJHRM-UHFFFAOYSA-N. SMILES: CCC(C)CC1=[NH+]C(=CC2=CC3=C(C=C21)OCO3)C.[Cl-].

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