2-butyl-6,7-dimethoxy-isoquinolin-2-ium chloride

Systemtic Name: 2-butyl-6,7-dimethoxy-isoquinolin-2-ium chloride Openeye Name: 2-butyl-6,7-dimethoxy-isoquinolin-2-ium chloride CAS Name: 2-butyl-6,7-dimethoxyisoquinolin-2-ium chloride IUPAC Name: 2-butyl-6,7-dimethoxyisoquinolin-2-ium chloride Traditional Name: 2-butyl-6,7-dimethoxy-isoquinolin-2-ium chloride Formula: C15H20ClNO2 MolecularWeight: 281.7778

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CC2=CC(=C(C=C2C=C1)OC)OC.[Cl-]

Isomeric SMILES

CCCC[N+]1=CC2=CC(=C(C=C2C=C1)OC)OC.[Cl-]

InChI

InChI=1S/C15H20NO2.ClH/c1-4-5-7-16-8-6-12-9-14(17-2)15(18-3)10-13(12)11-16;/h6,8-11H,4-5,7H2,1-3H3;1H/q+1;/p-1