(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl) 4-[bis(fluoranyl)methylsulfonyl]benzoate

Systemtic Name: (2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl) 4-[bis(fluoranyl)methylsulfonyl]benzoate Openeye Name: (2-oxo-3,4-dihydro-1H-quinolin-6-yl) 4-(difluoromethylsulfonyl)benzoate CAS Name: 4-(difluoromethylsulfonyl)benzoic acid (2-oxo-3,4-dihydro-1H-quinolin-6-yl) ester IUPAC Name: (2-oxo-3,4-dihydro-1H-quinolin-6-yl) 4-(difluoromethylsulfonyl)benzoate Traditional Name: 4-(difluoromethylsulfonyl)benzoic acid (2-keto-3,4-dihydro-1H-quinolin-6-yl) ester Formula: C17H13F2NO5S MolecularWeight: 381.350626

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C1C=C(C=C2)OC(=O)C3=CC=C(C=C3)S(=O)(=O)C(F)F

Isomeric SMILES

C1CC(=O)NC2=C1C=C(C=C2)OC(=O)C3=CC=C(C=C3)S(=O)(=O)C(F)F

InChI

InChI=1S/C17H13F2NO5S/c18-17(19)26(23,24)13-5-1-10(2-6-13)16(22)25-12-4-7-14-11(9-12)3-8-15(21)20-14/h1-2,4-7,9,17H,3,8H2,(H,20,21)