ethyl 2-(1-ethenyl-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)ethanoate bromide

Systemtic Name: ethyl 2-(1-ethenyl-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)ethanoate bromide Openeye Name: ethyl 2-(6,7-dimethoxy-2-methyl-1-vinyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)acetate bromide CAS Name: 2-(1-ethenyl-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)acetic acid ethyl ester bromide IUPAC Name: ethyl 2-(1-ethenyl-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)acetate bromide Traditional Name: 2-(6,7-dimethoxy-2-methyl-1-vinyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)acetic acid ethyl ester bromide Formula: C18H26BrNO4 MolecularWeight: 400.30734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1(CCC2=CC(=C(C=C2C1C=C)OC)OC)C.[Br-]

Isomeric SMILES

CCOC(=O)C[N+]1(CCC2=CC(=C(C=C2C1C=C)OC)OC)C.[Br-]

InChI

InChI=1S/C18H26NO4.BrH/c1-6-15-14-11-17(22-5)16(21-4)10-13(14)8-9-19(15,3)12-18(20)23-7-2;/h6,10-11,15H,1,7-9,12H2,2-5H3;1H/q+1;/p-1