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1-[2-(3-chloranylpropyl)-5-methoxy-phenyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium chloride

1-[2-(3-chloranylpropyl)-5-methoxy-phenyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium chloride

Systemtic Name:1-[2-(3-chloranylpropyl)-5-methoxy-phenyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium chloride
Openeye Name:1-[2-(3-chloropropyl)-5-methoxy-phenyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium chloride
CAS Name:1-[2-(3-chloropropyl)-5-methoxyphenyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium chloride
IUPAC Name:1-[2-(3-chloropropyl)-5-methoxyphenyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium chloride
Traditional Name:1-[2-(3-chloropropyl)-5-methoxy-phenyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium chloride
Formula: C21H25Cl2NO3
MolecularWeight: 410.3341
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CCCCl)C2=[NH+]CCC3=CC(=C(C=C32)OC)OC.[Cl-]


Isomeric SMILES

COC1=CC(=C(C=C1)CCCCl)C2=[NH+]CCC3=CC(=C(C=C32)OC)OC.[Cl-]


InChI

InChI=1S/C21H24ClNO3.ClH/c1-24-16-7-6-14(5-4-9-22)17(12-16)21-18-13-20(26-3)19(25-2)11-15(18)8-10-23-21;/h6-7,11-13H,4-5,8-10H2,1-3H3;1H


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