2-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)methylsulfanyl]benzoic acid

Molecular Formula: C21H23NO4S


InChI: InChI=1/C21H23NO4S/c1-21(2)11-13-9-17(25-3)18(26-4)10-15(13)16(22-21)12-27-19-8-6-5-7-14(19)20(23)24/h5-10H,11-12H2,1-4H3,(H,23,24)/f/h23H

InChIKey: InChIKey=ACPLMNUIXAQIPP-MPIMZMORCE
SMILES: CC1(CC2=CC(=C(C=C2C(=N1)CSC3=CC=CC=C3C(=O)O)OC)OC)C

Names:
    2-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)methylsulfanyl]benzoic acid

Registries:
    PubChem CID 1121308
    PubChem ID 4801110