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methyl (3R)-2-[2-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate
methyl (3R)-2-[2-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate
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Descriptors Computed from Structure
Canonical SMILES:
COC(=O)C1CC2=CC=CC=C2CN1S(=O)(=O)C3=CC=CC=C3C(F)(F)F
Isomeric SMILES
COC(=O)[C@H]1CC2=CC=CC=C2CN1S(=O)(=O)C3=CC=CC=C3C(F)(F)F
InChI
InChI=1S/C18H16F3NO4S/c1-26-17(23)15-10-12-6-2-3-7-13(12)11-22(15)27(24,25)16-9-5-4-8-14(16)18(19,20)21/h2-9,15H,10-11H2,1H3/t15-/m1/s1
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