4-[3-[3-ethanoyl-5-(trifluoromethyl)phenyl]-5,5-dimethyl-4-oxidanylidene-furan-2-yl]benzenesulfonamide

Systemtic Name: 4-[3-[3-ethanoyl-5-(trifluoromethyl)phenyl]-5,5-dimethyl-4-oxidanylidene-furan-2-yl]benzenesulfonamide Openeye Name: 4-[3-[3-acetyl-5-(trifluoromethyl)phenyl]-5,5-dimethyl-4-oxo-2-furyl]benzenesulfonamide CAS Name: 4-[3-[3-acetyl-5-(trifluoromethyl)phenyl]-5,5-dimethyl-4-oxo-2-furanyl]benzenesulfonamide IUPAC Name: 4-[3-[3-acetyl-5-(trifluoromethyl)phenyl]-5,5-dimethyl-4-oxofuran-2-yl]benzenesulfonamide Traditional Name: 4-[3-[3-acetyl-5-(trifluoromethyl)phenyl]-4-keto-5,5-dimethyl-2-furyl]benzenesulfonamide Formula: C21H18F3NO5S MolecularWeight: 453.43153

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC(=C1)C2=C(OC(C2=O)(C)C)C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F

Isomeric SMILES

CC(=O)C1=CC(=CC(=C1)C2=C(OC(C2=O)(C)C)C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F

InChI

InChI=1S/C21H18F3NO5S/c1-11(26)13-8-14(10-15(9-13)21(22,23)24)17-18(30-20(2,3)19(17)27)12-4-6-16(7-5-12)31(25,28)29/h4-10H,1-3H3,(H2,25,28,29)