(1S)-5,7-dimethoxy-1-pyridin-2-yl-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: (1S)-5,7-dimethoxy-1-pyridin-2-yl-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: (1S)-5,7-dimethoxy-1-(2-pyridyl)-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: (1S)-5,7-dimethoxy-1-(2-pyridinyl)-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: (1S)-5,7-dimethoxy-1-pyridin-2-yl-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: (1S)-5,7-dimethoxy-1-(2-pyridyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C16H19N2O2+ MolecularWeight: 271.33426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2CC[NH2+]C(C2=C1)C3=CC=CC=N3)OC

Isomeric SMILES

COC1=CC(=C2CC[NH2+][C@@H](C2=C1)C3=CC=CC=N3)OC

InChI

InChI=1S/C16H18N2O2/c1-19-11-9-13-12(15(10-11)20-2)6-8-18-16(13)14-5-3-4-7-17-14/h3-5,7,9-10,16,18H,6,8H2,1-2H3/p+1/t16-/m0/s1