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

Systemtic Name: [2-oxidanylidene-7-[3-(trifluoromethyl)phenyl]-1,3-benzoxathiol-5-yl] 2-chloranylbenzoate Openeye Name: [2-oxo-7-[3-(trifluoromethyl)phenyl]-1,3-benzoxathiol-5-yl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic 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] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [2-keto-7-[3-(trifluoromethyl)phenyl]-1,3-benzoxathiol-5-yl] ester Formula: C21H10ClF3O4S MolecularWeight: 450.81491

Click to see the large picture

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)Cl

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)Cl

InChI

InChI=1S/C21H10ClF3O4S/c22-16-7-2-1-6-14(16)19(26)28-13-9-15(18-17(10-13)30-20(27)29-18)11-4-3-5-12(8-11)21(23,24)25/h1-10H