2-methyl-4-[3-(3-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]oxy-butan-2-ol

Systemtic Name: 2-methyl-4-[3-(3-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]oxy-butan-2-ol Openeye Name: 2-methyl-4-[[3-(3-methylsulfonylphenyl)-5-(trifluoromethyl)-2-pyridyl]oxy]butan-2-ol CAS Name: 2-methyl-4-[[3-(3-methylsulfonylphenyl)-5-(trifluoromethyl)-2-pyridinyl]oxy]-2-butanol IUPAC Name: 2-methyl-4-[3-(3-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]oxybutan-2-ol Traditional Name: 4-[[3-(3-mesylphenyl)-5-(trifluoromethyl)-2-pyridyl]oxy]-2-methyl-butan-2-ol Formula: C18H20F3NO4S MolecularWeight: 403.41591

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCOC1=NC=C(C=C1C2=CC(=CC=C2)S(=O)(=O)C)C(F)(F)F)O

Isomeric SMILES

CC(C)(CCOC1=NC=C(C=C1C2=CC(=CC=C2)S(=O)(=O)C)C(F)(F)F)O

InChI

InChI=1S/C18H20F3NO4S/c1-17(2,23)7-8-26-16-15(10-13(11-22-16)18(19,20)21)12-5-4-6-14(9-12)27(3,24)25/h4-6,9-11,23H,7-8H2,1-3H3