[2-(1-benzofuran-2-yl)pyridin-4-yl] 4,4,4-tris(fluoranyl)butane-1-sulfonate

Systemtic Name: [2-(1-benzofuran-2-yl)pyridin-4-yl] 4,4,4-tris(fluoranyl)butane-1-sulfonate Openeye Name: [2-(benzofuran-2-yl)-4-pyridyl] 4,4,4-trifluorobutane-1-sulfonate CAS Name: 4,4,4-trifluoro-1-butanesulfonic acid IUPAC Name: [2-(1-benzofuran-2-yl)pyridin-4-yl] 4,4,4-trifluorobutane-1-sulfonate Traditional Name: 4,4,4-trifluorobutane-1-sulfonic acid [2-(benzofuran-2-yl)-4-pyridyl] ester Formula: C17H14F3NO4S MolecularWeight: 385.35757

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C3=NC=CC(=C3)OS(=O)(=O)CCCC(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C3=NC=CC(=C3)OS(=O)(=O)CCCC(F)(F)F

InChI

InChI=1S/C17H14F3NO4S/c18-17(19,20)7-3-9-26(22,23)25-13-6-8-21-14(11-13)16-10-12-4-1-2-5-15(12)24-16/h1-2,4-6,8,10-11H,3,7,9H2