2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethyl 4-methylbenzoate

Systemtic Name: 2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethyl 4-methylbenzoate Openeye Name: 2-[[5-(trifluoromethyl)-2-pyridyl]sulfonyl]ethyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid 2-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]ethyl ester IUPAC Name: 2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid 2-[[5-(trifluoromethyl)-2-pyridyl]sulfonyl]ethyl ester Formula: C16H14F3NO4S MolecularWeight: 373.34687

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCCS(=O)(=O)C2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCCS(=O)(=O)C2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C16H14F3NO4S/c1-11-2-4-12(5-3-11)15(21)24-8-9-25(22,23)14-7-6-13(10-20-14)16(17,18)19/h2-7,10H,8-9H2,1H3