ethyl 1-[5-cyano-4-(3-hydroxyphenyl)-6-(trifluoromethylsulfonyloxy)pyridin-2-yl]cyclopropane-1-carboxylate

Systemtic Name: ethyl 1-[5-cyano-4-(3-hydroxyphenyl)-6-(trifluoromethylsulfonyloxy)pyridin-2-yl]cyclopropane-1-carboxylate Openeye Name: ethyl 1-[5-cyano-4-(3-hydroxyphenyl)-6-(trifluoromethylsulfonyloxy)-2-pyridyl]cyclopropanecarboxylate CAS Name: 1-[5-cyano-4-(3-hydroxyphenyl)-6-(trifluoromethylsulfonyloxy)-2-pyridinyl]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-cyano-4-(3-hydroxyphenyl)-6-(trifluoromethylsulfonyloxy)pyridin-2-yl]cyclopropane-1-carboxylate Traditional Name: 1-[5-cyano-4-(3-hydroxyphenyl)-6-triflyloxy-2-pyridyl]cyclopropanecarboxylic acid ethyl ester Formula: C19H15F3N2O6S MolecularWeight: 456.39241

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC1)C2=NC(=C(C(=C2)C3=CC(=CC=C3)O)C#N)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1(CC1)C2=NC(=C(C(=C2)C3=CC(=CC=C3)O)C#N)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C19H15F3N2O6S/c1-2-29-17(26)18(6-7-18)15-9-13(11-4-3-5-12(25)8-11)14(10-23)16(24-15)30-31(27,28)19(20,21)22/h3-5,8-9,25H,2,6-7H2,1H3