quinolin-8-yl 2,4-bis(trifluoromethyl)benzenesulfonate

Systemtic Name: quinolin-8-yl 2,4-bis(trifluoromethyl)benzenesulfonate Openeye Name: 8-quinolyl 2,4-bis(trifluoromethyl)benzenesulfonate CAS Name: 2,4-bis(trifluoromethyl)benzenesulfonic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl 2,4-bis(trifluoromethyl)benzenesulfonate Traditional Name: 2,4-bis(trifluoromethyl)benzenesulfonic acid 8-quinolyl ester Formula: C17H9F6NO3S MolecularWeight: 421.313679

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)OS(=O)(=O)C3=C(C=C(C=C3)C(F)(F)F)C(F)(F)F)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)OS(=O)(=O)C3=C(C=C(C=C3)C(F)(F)F)C(F)(F)F)N=CC=C2

InChI

InChI=1S/C17H9F6NO3S/c18-16(19,20)11-6-7-14(12(9-11)17(21,22)23)28(25,26)27-13-5-1-3-10-4-2-8-24-15(10)13/h1-9H