6,7-dimethoxy-2-[3-(trifluoromethyloxy)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethoxy-2-[3-(trifluoromethyloxy)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 6,7-dimethoxy-2-[3-(trifluoromethoxy)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 6,7-dimethoxy-2-[3-(trifluoromethoxy)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 6,7-dimethoxy-2-[3-(trifluoromethoxy)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 6,7-dimethoxy-2-[3-(trifluoromethoxy)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline Formula: C18H18F3NO5S MolecularWeight: 417.39943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)C3=CC=CC(=C3)OC(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)C3=CC=CC(=C3)OC(F)(F)F)OC

InChI

InChI=1S/C18H18F3NO5S/c1-25-16-8-12-6-7-22(11-13(12)9-17(16)26-2)28(23,24)15-5-3-4-14(10-15)27-18(19,20)21/h3-5,8-10H,6-7,11H2,1-2H3