1-methyl-2-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]oxy-cyclohexan-1-ol

Systemtic Name: 1-methyl-2-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]oxy-cyclohexan-1-ol Openeye Name: 1-methyl-2-[[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-2-pyridyl]oxy]cyclohexanol CAS Name: 1-methyl-2-[[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-2-pyridinyl]oxy]-1-cyclohexanol IUPAC Name: 1-methyl-2-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]oxycyclohexan-1-ol Traditional Name: 2-[[3-(4-mesylphenyl)-5-(trifluoromethyl)-2-pyridyl]oxy]-1-methyl-cyclohexanol Formula: C20H22F3NO4S MolecularWeight: 429.45319

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1OC2=NC=C(C=C2C3=CC=C(C=C3)S(=O)(=O)C)C(F)(F)F)O

Isomeric SMILES

CC1(CCCCC1OC2=NC=C(C=C2C3=CC=C(C=C3)S(=O)(=O)C)C(F)(F)F)O

InChI

InChI=1S/C20H22F3NO4S/c1-19(25)10-4-3-5-17(19)28-18-16(11-14(12-24-18)20(21,22)23)13-6-8-15(9-7-13)29(2,26)27/h6-9,11-12,17,25H,3-5,10H2,1-2H3