2-(6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanoic acid

Systemtic Name: 2-(6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanoic acid Openeye Name: 2-(6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetic acid CAS Name: 2-(6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetic acid IUPAC Name: 2-(6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetic acid Traditional Name: 2-(6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetic acid Formula: C14H20NO4+ MolecularWeight: 266.3129

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CC[NH+]1CC(=O)O)OC)OC

Isomeric SMILES

CC1C2=CC(=C(C=C2CC[NH+]1CC(=O)O)OC)OC

InChI

InChI=1S/C14H19NO4/c1-9-11-7-13(19-3)12(18-2)6-10(11)4-5-15(9)8-14(16)17/h6-7,9H,4-5,8H2,1-3H3,(H,16,17)/p+1