[2-oxidanylidene-7-[3-(trifluoromethyl)phenyl]-1,3-benzoxathiol-5-yl] benzoate

Systemtic Name: [2-oxidanylidene-7-[3-(trifluoromethyl)phenyl]-1,3-benzoxathiol-5-yl] benzoate Openeye Name: [2-oxo-7-[3-(trifluoromethyl)phenyl]-1,3-benzoxathiol-5-yl] benzoate CAS Name: benzoic acid [2-oxo-7-[3-(trifluoromethyl)phenyl]-1,3-benzoxathiol-5-yl] ester IUPAC Name: [2-oxo-7-[3-(trifluoromethyl)phenyl]-1,3-benzoxathiol-5-yl] benzoate Traditional Name: benzoic acid [2-keto-7-[3-(trifluoromethyl)phenyl]-1,3-benzoxathiol-5-yl] ester Formula: C21H11F3O4S MolecularWeight: 416.36985

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=CC3=C(C(=C2)C4=CC(=CC=C4)C(F)(F)F)OC(=O)S3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=CC3=C(C(=C2)C4=CC(=CC=C4)C(F)(F)F)OC(=O)S3

InChI

InChI=1S/C21H11F3O4S/c22-21(23,24)14-8-4-7-13(9-14)16-10-15(11-17-18(16)28-20(26)29-17)27-19(25)12-5-2-1-3-6-12/h1-11H