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

Systemtic Name: (1S)-1-(4-ethoxyphenyl)-7-methoxy-spiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] Openeye Name: (1S)-1-(4-ethoxyphenyl)-7-methoxy-spiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] CAS Name: (1S)-1-(4-ethoxyphenyl)-7-methoxyspiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] IUPAC Name: (1S)-1-(4-ethoxyphenyl)-7-methoxyspiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] Traditional Name: (1S)-7-methoxy-1-p-phenetyl-spiro[2,3-dihydro-1H-isoquinolin-2-ium-4,1'-cyclopentane] Formula: C22H28NO2+ MolecularWeight: 338.46322

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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

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H]2C3=C(C=CC(=C3)OC)C4(CCCC4)C[NH2+]2

InChI

InChI=1S/C22H27NO2/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/p+1/t21-/m0/s1