methyl 3-(6,7-dimethoxyspiro[2,3-dihydro-1H-isoquinolin-2-ium-4,4'-oxane]-2-yl)propanoate

Systemtic Name: methyl 3-(6,7-dimethoxyspiro[2,3-dihydro-1H-isoquinolin-2-ium-4,4'-oxane]-2-yl)propanoate Openeye Name: methyl 3-(6,7-dimethoxyspiro[2,3-dihydro-1H-isoquinolin-2-ium-4,4'-tetrahydropyran]-2-yl)propanoate CAS Name: 3-(6,7-dimethoxy-2-spiro[2,3-dihydro-1H-isoquinolin-2-ium-4,4'-oxane]yl)propanoic acid methyl ester IUPAC Name: methyl 3-(6,7-dimethoxyspiro[2,3-dihydro-1H-isoquinolin-2-ium-4,4'-oxane]-2-yl)propanoate Traditional Name: 3-(6,7-dimethoxyspiro[2,3-dihydro-1H-isoquinolin-2-ium-4,4'-tetrahydropyran]-2-yl)propionic acid methyl ester Formula: C19H28NO5+ MolecularWeight: 350.42932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C[NH+](CC23CCOCC3)CCC(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C[NH+](CC23CCOCC3)CCC(=O)OC)OC

InChI

InChI=1S/C19H27NO5/c1-22-16-10-14-12-20(7-4-18(21)24-3)13-19(5-8-25-9-6-19)15(14)11-17(16)23-2/h10-11H,4-9,12-13H2,1-3H3/p+1