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

Systemtic Name: methyl 3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanoate Openeye Name: methyl 3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanoate CAS Name: 3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanoate Traditional Name: 3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propionic acid methyl ester Formula: C15H22NO4+ MolecularWeight: 280.33948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH+](CCC2=C1)CCC(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2C[NH+](CCC2=C1)CCC(=O)OC)OC

InChI

InChI=1S/C15H21NO4/c1-18-13-8-11-4-6-16(7-5-15(17)20-3)10-12(11)9-14(13)19-2/h8-9H,4-7,10H2,1-3H3/p+1