ethyl 4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidine-1-carboxylate

Systemtic Name: ethyl 4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidine-1-carboxylate Openeye Name: ethyl 4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidine-1-carboxylate CAS Name: 4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidine-1-carboxylate Traditional Name: 4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidine-1-carboxylic acid ethyl ester Formula: C19H29N2O4+ MolecularWeight: 349.44456

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)[NH+]2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)[NH+]2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C19H28N2O4/c1-4-25-19(22)20-9-6-16(7-10-20)21-8-5-14-11-17(23-2)18(24-3)12-15(14)13-21/h11-12,16H,4-10,13H2,1-3H3/p+1