[(2S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1H-indol-3-yl)propan-2-yl]azanium

Systemtic Name: [(2S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1H-indol-3-yl)propan-2-yl]azanium Openeye Name: [(1S)-1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-(1H-indol-3-yl)ethyl]ammonium CAS Name: [(2S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1H-indol-3-yl)propan-2-yl]ammonium IUPAC Name: [(2S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1H-indol-3-yl)propan-2-yl]azanium Traditional Name: [(1S)-1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-(1H-indol-3-yl)ethyl]ammonium Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CC(CC3=CNC4=CC=CC=C43)[NH3+])OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C[C@H](CC3=CNC4=CC=CC=C43)[NH3+])OC

InChI

InChI=1S/C22H27N3O2/c1-26-21-10-15-7-8-25(13-17(15)11-22(21)27-2)14-18(23)9-16-12-24-20-6-4-3-5-19(16)20/h3-6,10-12,18,24H,7-9,13-14,23H2,1-2H3/p+1/t18-/m0/s1