methyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propyl sulfate

Systemtic Name: methyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propyl sulfate Openeye Name: methyl 2-[4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenoxy]propyl sulfate CAS Name: sulfuric acid methyl 2-[4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]propyl ester IUPAC Name: methyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propyl sulfate Traditional Name: sulfuric acid methyl 2-[4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenoxy]propyl ester Formula: C16H16F3NO6S MolecularWeight: 407.36155

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Descriptors Computed from Structure

Canonical SMILES:

CC(COS(=O)(=O)OC)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(COS(=O)(=O)OC)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C16H16F3NO6S/c1-11(10-24-27(21,22)23-2)25-13-4-6-14(7-5-13)26-15-8-3-12(9-20-15)16(17,18)19/h3-9,11H,10H2,1-2H3