2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]isoquinolin-2-ium

Systemtic Name: 2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]isoquinolin-2-ium Openeye Name: 2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]isoquinolin-2-ium CAS Name: 2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]isoquinolin-2-ium IUPAC Name: 2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]isoquinolin-2-ium Traditional Name: 2-methyl-1-(3,4,5-trimethoxybenzyl)isoquinolin-2-ium Formula: C20H22NO3+ MolecularWeight: 324.39358

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=CC=CC=C2C=C1)CC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

C[N+]1=C(C2=CC=CC=C2C=C1)CC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C20H22NO3/c1-21-10-9-15-7-5-6-8-16(15)17(21)11-14-12-18(22-2)20(24-4)19(13-14)23-3/h5-10,12-13H,11H2,1-4H3/q+1