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

Systemtic Name: 2-[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline Formula: C16H13BrF3NO3S MolecularWeight: 436.24353

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

InChI

InChI=1S/C16H13BrF3NO3S/c17-13-5-6-15(14(9-13)24-16(18,19)20)25(22,23)21-8-7-11-3-1-2-4-12(11)10-21/h1-6,9H,7-8,10H2