1-(1H-indol-3-yl)-2-[(1R)-7-methoxy-1-methyl-6-oxidanyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]ethanone

Systemtic Name: 1-(1H-indol-3-yl)-2-[(1R)-7-methoxy-1-methyl-6-oxidanyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]ethanone Openeye Name: 2-[(1R)-6-hydroxy-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-1-(1H-indol-3-yl)ethanone CAS Name: 2-[(1R)-6-hydroxy-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-1-(1H-indol-3-yl)ethanone IUPAC Name: 2-[(1R)-6-hydroxy-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-1-(1H-indol-3-yl)ethanone Traditional Name: 2-[(1R)-6-hydroxy-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-1-(1H-indol-3-yl)ethanone Formula: C21H23N2O3+ MolecularWeight: 351.41892

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CC[NH+]1CC(=O)C3=CNC4=CC=CC=C43)O)OC

Isomeric SMILES

C[C@@H]1C2=CC(=C(C=C2CC[NH+]1CC(=O)C3=CNC4=CC=CC=C43)O)OC

InChI

InChI=1S/C21H22N2O3/c1-13-16-10-21(26-2)19(24)9-14(16)7-8-23(13)12-20(25)17-11-22-18-6-4-3-5-15(17)18/h3-6,9-11,13,22,24H,7-8,12H2,1-2H3/p+1/t13-/m1/s1