2-[3-(trifluoromethyl)phenyl]sulfanylethyl 3-morpholin-4-ylsulfonylbenzoate

Systemtic Name: 2-[3-(trifluoromethyl)phenyl]sulfanylethyl 3-morpholin-4-ylsulfonylbenzoate Openeye Name: 2-[3-(trifluoromethyl)phenyl]sulfanylethyl 3-morpholinosulfonylbenzoate CAS Name: 3-(4-morpholinylsulfonyl)benzoic acid 2-[[3-(trifluoromethyl)phenyl]thio]ethyl ester IUPAC Name: 2-[3-(trifluoromethyl)phenyl]sulfanylethyl 3-morpholin-4-ylsulfonylbenzoate Traditional Name: 3-morpholinosulfonylbenzoic acid 2-[[3-(trifluoromethyl)phenyl]thio]ethyl ester Formula: C20H20F3NO5S2 MolecularWeight: 475.50171

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)OCCSC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)OCCSC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H20F3NO5S2/c21-20(22,23)16-4-2-5-17(14-16)30-12-11-29-19(25)15-3-1-6-18(13-15)31(26,27)24-7-9-28-10-8-24/h1-6,13-14H,7-12H2