(2-chloranylquinolin-3-yl)methyl 4-[bis(fluoranyl)methylsulfonyl]benzoate

Systemtic Name: (2-chloranylquinolin-3-yl)methyl 4-[bis(fluoranyl)methylsulfonyl]benzoate Openeye Name: (2-chloro-3-quinolyl)methyl 4-(difluoromethylsulfonyl)benzoate CAS Name: 4-(difluoromethylsulfonyl)benzoic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl 4-(difluoromethylsulfonyl)benzoate Traditional Name: 4-(difluoromethylsulfonyl)benzoic acid (2-chloro-3-quinolyl)methyl ester Formula: C18H12ClF2NO4S MolecularWeight: 411.806986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)Cl)COC(=O)C3=CC=C(C=C3)S(=O)(=O)C(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)Cl)COC(=O)C3=CC=C(C=C3)S(=O)(=O)C(F)F

InChI

InChI=1S/C18H12ClF2NO4S/c19-16-13(9-12-3-1-2-4-15(12)22-16)10-26-17(23)11-5-7-14(8-6-11)27(24,25)18(20)21/h1-9,18H,10H2