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

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 4-methyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 4-methyl-3-morpholinosulfonyl-benzoate CAS Name: 4-methyl-3-(4-morpholinylsulfonyl)benzoic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 4-methyl-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methyl-3-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)C(=O)OCC2=CC(=CC=C2)C(F)(F)F)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CC(=CC=C2)C(F)(F)F)S(=O)(=O)N3CCOCC3

InChI

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