(5-chloranylquinolin-8-yl) 4-[bis(fluoranyl)methylsulfonyl]benzoate

Systemtic Name: (5-chloranylquinolin-8-yl) 4-[bis(fluoranyl)methylsulfonyl]benzoate Openeye Name: (5-chloro-8-quinolyl) 4-(difluoromethylsulfonyl)benzoate CAS Name: 4-(difluoromethylsulfonyl)benzoic acid (5-chloro-8-quinolinyl) ester IUPAC Name: (5-chloroquinolin-8-yl) 4-(difluoromethylsulfonyl)benzoate Traditional Name: 4-(difluoromethylsulfonyl)benzoic acid (5-chloro-8-quinolyl) ester Formula: C17H10ClF2NO4S MolecularWeight: 397.780406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)OC(=O)C3=CC=C(C=C3)S(=O)(=O)C(F)F)Cl

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)OC(=O)C3=CC=C(C=C3)S(=O)(=O)C(F)F)Cl

InChI

InChI=1S/C17H10ClF2NO4S/c18-13-7-8-14(15-12(13)2-1-9-21-15)25-16(22)10-3-5-11(6-4-10)26(23,24)17(19)20/h1-9,17H