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

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

Systemtic Name:7-methyl-5-(2-methylbutan-2-yl)-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride
Openeye Name:5-(1,1-dimethylpropyl)-7-methyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride
CAS Name:7-methyl-5-(2-methylbutan-2-yl)-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride
IUPAC Name:7-methyl-5-(2-methylbutan-2-yl)-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride
Traditional Name:5-tert-amyl-7-methyl-[1,3]dioxol[4,5-g]isoquinolin-6-ium chloride
Formula: C16H20ClNO2
MolecularWeight: 293.7885
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=[NH+]C(=CC2=CC3=C(C=C21)OCO3)C.[Cl-]


Isomeric SMILES

CCC(C)(C)C1=[NH+]C(=CC2=CC3=C(C=C21)OCO3)C.[Cl-]


InChI

InChI=1S/C16H19NO2.ClH/c1-5-16(3,4)15-12-8-14-13(18-9-19-14)7-11(12)6-10(2)17-15;/h6-8H,5,9H2,1-4H3;1H


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