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

Systemtic Name: 6,7-dimethoxy-2-(1-methylpiperidin-1-ium-4-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 6,7-dimethoxy-2-(1-methylpiperidin-1-ium-4-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 6,7-dimethoxy-2-(1-methyl-4-piperidin-1-iumyl)-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 6,7-dimethoxy-2-(1-methylpiperidin-1-ium-4-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 6,7-dimethoxy-2-(1-methylpiperidin-1-ium-4-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C17H28N2O2+2 MolecularWeight: 292.41642

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+]2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+]2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C17H26N2O2/c1-18-7-5-15(6-8-18)19-9-4-13-10-16(20-2)17(21-3)11-14(13)12-19/h10-11,15H,4-9,12H2,1-3H3/p+2