(1S)-5,8-dimethoxy-1-pyridin-3-yl-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: (1S)-5,8-dimethoxy-1-pyridin-3-yl-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: (1S)-5,8-dimethoxy-1-(3-pyridyl)-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: (1S)-5,8-dimethoxy-1-(3-pyridinyl)-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: (1S)-5,8-dimethoxy-1-pyridin-3-yl-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: (1S)-5,8-dimethoxy-1-(3-pyridyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C16H19N2O2+ MolecularWeight: 271.33426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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