1-(4-ethoxyphenyl)-7-methoxy-spiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] chloride

Systemtic Name: 1-(4-ethoxyphenyl)-7-methoxy-spiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] chloride Openeye Name: 1-(4-ethoxyphenyl)-7-methoxy-spiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] chloride CAS Name: 1-(4-ethoxyphenyl)-7-methoxyspiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] chloride IUPAC Name: 1-(4-ethoxyphenyl)-7-methoxyspiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] chloride Traditional Name: 7-methoxy-1-p-phenetyl-spiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] chloride Formula: C22H28ClNO2 MolecularWeight: 373.91622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C3=C(C=CC(=C3)OC)C4(CCCC4)C[NH2+]2.[Cl-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2C3=C(C=CC(=C3)OC)C4(CCCC4)C[NH2+]2.[Cl-]

InChI

InChI=1S/C22H27NO2.ClH/c1-3-25-17-8-6-16(7-9-17)21-19-14-18(24-2)10-11-20(19)22(15-23-21)12-4-5-13-22;/h6-11,14,21,23H,3-5,12-13,15H2,1-2H3;1H