(1S)-1-(1H-indol-3-yl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: (1S)-1-(1H-indol-3-yl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: (1S)-1-(1H-indol-3-yl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: (1S)-1-(1H-indol-3-yl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: (1S)-1-(1H-indol-3-yl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: (1S)-1-(1H-indol-3-yl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C19H21N2O2+ MolecularWeight: 309.38224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C([NH2+]CCC2=C1)C3=CNC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C=C2[C@H]([NH2+]CCC2=C1)C3=CNC4=CC=CC=C43)OC

InChI

InChI=1S/C19H20N2O2/c1-22-17-9-12-7-8-20-19(14(12)10-18(17)23-2)15-11-21-16-6-4-3-5-13(15)16/h3-6,9-11,19-21H,7-8H2,1-2H3/p+1/t19-/m0/s1