[5-methyl-4-oxidanylidene-3-[[3-(trifluoromethyl)phenyl]carbonyloxymethyl]-2H-thiochromen-3-yl]methyl 3-(trifluoromethyl)benzoate

Systemtic Name: [5-methyl-4-oxidanylidene-3-[[3-(trifluoromethyl)phenyl]carbonyloxymethyl]-2H-thiochromen-3-yl]methyl 3-(trifluoromethyl)benzoate Openeye Name: [5-methyl-4-oxo-3-[[3-(trifluoromethyl)benzoyl]oxymethyl]thiochroman-3-yl]methyl 3-(trifluoromethyl)benzoate CAS Name: 3-(trifluoromethyl)benzoic acid [5-methyl-4-oxo-3-[[oxo-[3-(trifluoromethyl)phenyl]methoxy]methyl]-2H-1-benzothiopyran-3-yl]methyl ester IUPAC Name: [5-methyl-4-oxo-3-[[3-(trifluoromethyl)benzoyl]oxymethyl]-2H-thiochromen-3-yl]methyl 3-(trifluoromethyl)benzoate Traditional Name: 3-(trifluoromethyl)benzoic acid [4-keto-5-methyl-3-[[3-(trifluoromethyl)benzoyl]oxymethyl]thiochroman-3-yl]methyl ester Formula: C28H20F6O5S MolecularWeight: 582.510819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SCC(C2=O)(COC(=O)C3=CC(=CC=C3)C(F)(F)F)COC(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC1=C2C(=CC=C1)SCC(C2=O)(COC(=O)C3=CC(=CC=C3)C(F)(F)F)COC(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C28H20F6O5S/c1-16-5-2-10-21-22(16)23(35)26(15-40-21,13-38-24(36)17-6-3-8-19(11-17)27(29,30)31)14-39-25(37)18-7-4-9-20(12-18)28(32,33)34/h2-12H,13-15H2,1H3