[3-(trifluoromethyl)phenyl]methyl 2-methyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 2-methyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 2-methyl-5-morpholinosulfonyl-benzoate CAS Name: 2-methyl-5-(4-morpholinylsulfonyl)benzoic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 2-methyl-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methyl-5-morpholinosulfonyl-benzoic acid [3-(trifluoromethyl)benzyl] ester Formula: C20H20F3NO5S MolecularWeight: 443.43671

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H20F3NO5S/c1-14-5-6-17(30(26,27)24-7-9-28-10-8-24)12-18(14)19(25)29-13-15-3-2-4-16(11-15)20(21,22)23/h2-6,11-12H,7-10,13H2,1H3