[2-(pyridin-4-ylmethyl)phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [2-(pyridin-4-ylmethyl)phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [2-(4-pyridylmethyl)phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2-(pyridin-4-ylmethyl)phenyl] ester IUPAC Name: [2-(pyridin-4-ylmethyl)phenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2-(4-pyridylmethyl)phenyl] ester Formula: C13H10F3NO3S MolecularWeight: 317.28361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=CC=NC=C2)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)CC2=CC=NC=C2)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C13H10F3NO3S/c14-13(15,16)21(18,19)20-12-4-2-1-3-11(12)9-10-5-7-17-8-6-10/h1-8H,9H2