2-[4-[bis(fluoranyl)methylsulfonyl]phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[4-[bis(fluoranyl)methylsulfonyl]phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[4-(difluoromethylsulfonyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-[4-(difluoromethylsulfonyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[4-(difluoromethylsulfonyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[4-(difluoromethylsulfonyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline Formula: C16H15F2NO4S2 MolecularWeight: 387.421406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15F2NO4S2/c17-16(18)24(20,21)14-5-7-15(8-6-14)25(22,23)19-10-9-12-3-1-2-4-13(12)11-19/h1-8,16H,9-11H2