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2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanenitrile chloride

2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanenitrile chloride

Systemtic Name:2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanenitrile chloride
Openeye Name:2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetonitrile chloride
CAS Name:2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetonitrile chloride
IUPAC Name:2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetonitrile chloride
Traditional Name:2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetonitrile chloride
Formula: C13H17ClN2O2
MolecularWeight: 268.73928
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH+](CCC2=C1)CC#N)OC.[Cl-]


Isomeric SMILES

COC1=C(C=C2C[NH+](CCC2=C1)CC#N)OC.[Cl-]


InChI

InChI=1S/C13H16N2O2.ClH/c1-16-12-7-10-3-5-15(6-4-14)9-11(10)8-13(12)17-2;/h7-8H,3,5-6,9H2,1-2H3;1H


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