methyl 2-[2-(6,7-dimethoxy-1,2-dimethyl-isoquinolin-2-ium-3-yl)-4,5-dimethoxy-phenyl]ethanoate

Systemtic Name: methyl 2-[2-(6,7-dimethoxy-1,2-dimethyl-isoquinolin-2-ium-3-yl)-4,5-dimethoxy-phenyl]ethanoate Openeye Name: methyl 2-[2-(6,7-dimethoxy-1,2-dimethyl-isoquinolin-2-ium-3-yl)-4,5-dimethoxy-phenyl]acetate CAS Name: 2-[2-(6,7-dimethoxy-1,2-dimethyl-3-isoquinolin-2-iumyl)-4,5-dimethoxyphenyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(6,7-dimethoxy-1,2-dimethylisoquinolin-2-ium-3-yl)-4,5-dimethoxyphenyl]acetate Traditional Name: 2-[2-(6,7-dimethoxy-1,2-dimethyl-isoquinolin-2-ium-3-yl)-4,5-dimethoxy-phenyl]acetic acid methyl ester Formula: C24H28NO6+ MolecularWeight: 426.48222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=CC2=CC(=C(C=C12)OC)OC)C3=CC(=C(C=C3CC(=O)OC)OC)OC)C

Isomeric SMILES

CC1=[N+](C(=CC2=CC(=C(C=C12)OC)OC)C3=CC(=C(C=C3CC(=O)OC)OC)OC)C

InChI

InChI=1S/C24H28NO6/c1-14-17-12-22(29-5)20(27-3)9-15(17)8-19(25(14)2)18-13-23(30-6)21(28-4)10-16(18)11-24(26)31-7/h8-10,12-13H,11H2,1-7H3/q+1