6,7-dimethoxy-2-prop-2-ynyl-spiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] chloride

Systemtic Name: 6,7-dimethoxy-2-prop-2-ynyl-spiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] chloride Openeye Name: 6,7-dimethoxy-2-prop-2-ynyl-spiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] chloride CAS Name: 6,7-dimethoxy-2-prop-2-ynylspiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] chloride IUPAC Name: 6,7-dimethoxy-2-prop-2-ynylspiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] chloride Traditional Name: 6,7-dimethoxy-2-propargyl-spiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] chloride Formula: C18H24ClNO2 MolecularWeight: 321.84166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C[NH+](CC23CCCC3)CC#C)OC.[Cl-]

Isomeric SMILES

COC1=C(C=C2C(=C1)C[NH+](CC23CCCC3)CC#C)OC.[Cl-]

InChI

InChI=1S/C18H23NO2.ClH/c1-4-9-19-12-14-10-16(20-2)17(21-3)11-15(14)18(13-19)7-5-6-8-18;/h1,10-11H,5-9,12-13H2,2-3H3;1H