methyl 2-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]-2-oxidanyl-propanoate

Systemtic Name: methyl 2-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]-2-oxidanyl-propanoate Openeye Name: methyl 2-hydroxy-2-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-2-pyridyl]propanoate CAS Name: 2-hydroxy-2-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-2-pyridinyl]propanoic acid methyl ester IUPAC Name: methyl 2-hydroxy-2-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]propanoate Traditional Name: 2-hydroxy-2-[3-(4-mesylphenyl)-5-(trifluoromethyl)-2-pyridyl]propionic acid methyl ester Formula: C17H16F3NO5S MolecularWeight: 403.37285

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=C(C=C1C2=CC=C(C=C2)S(=O)(=O)C)C(F)(F)F)(C(=O)OC)O

Isomeric SMILES

CC(C1=NC=C(C=C1C2=CC=C(C=C2)S(=O)(=O)C)C(F)(F)F)(C(=O)OC)O

InChI

InChI=1S/C17H16F3NO5S/c1-16(23,15(22)26-2)14-13(8-11(9-21-14)17(18,19)20)10-4-6-12(7-5-10)27(3,24)25/h4-9,23H,1-3H3