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

Systemtic Name: methyl 2-[2-[6,7-dimethoxy-1-methyl-2-(phenylmethyl)isoquinolin-2-ium-3-yl]-4,5-dimethoxy-phenyl]ethanoate Openeye Name: methyl 2-[2-(2-benzyl-6,7-dimethoxy-1-methyl-isoquinolin-2-ium-3-yl)-4,5-dimethoxy-phenyl]acetate CAS Name: 2-[2-[6,7-dimethoxy-1-methyl-2-(phenylmethyl)-3-isoquinolin-2-iumyl]-4,5-dimethoxyphenyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(2-benzyl-6,7-dimethoxy-1-methylisoquinolin-2-ium-3-yl)-4,5-dimethoxyphenyl]acetate Traditional Name: 2-[2-(2-benzyl-6,7-dimethoxy-1-methyl-isoquinolin-2-ium-3-yl)-4,5-dimethoxy-phenyl]acetic acid methyl ester Formula: C30H32NO6+ MolecularWeight: 502.57818

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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)CC4=CC=CC=C4

Isomeric SMILES

CC1=[N+](C(=CC2=CC(=C(C=C12)OC)OC)C3=CC(=C(C=C3CC(=O)OC)OC)OC)CC4=CC=CC=C4

InChI

InChI=1S/C30H32NO6/c1-19-23-16-28(35-4)26(33-2)13-21(23)12-25(31(19)18-20-10-8-7-9-11-20)24-17-29(36-5)27(34-3)14-22(24)15-30(32)37-6/h7-14,16-17H,15,18H2,1-6H3/q+1