[2,6-bis(octanoylamino)pyridin-4-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [2,6-bis(octanoylamino)pyridin-4-yl] tris(fluoranyl)methanesulfonate Openeye Name: [2,6-bis(octanoylamino)-4-pyridyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2,6-bis(1-oxooctylamino)-4-pyridinyl] ester IUPAC Name: [2,6-bis(octanoylamino)pyridin-4-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2,6-bis(caprylylamino)-4-pyridyl] ester Formula: C22H34F3N3O5S MolecularWeight: 509.58267

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=CC(=CC(=N1)NC(=O)CCCCCCC)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCCCCCCC(=O)NC1=CC(=CC(=N1)NC(=O)CCCCCCC)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C22H34F3N3O5S/c1-3-5-7-9-11-13-20(29)27-18-15-17(33-34(31,32)22(23,24)25)16-19(26-18)28-21(30)14-12-10-8-6-4-2/h15-16H,3-14H2,1-2H3,(H2,26,27,28,29,30)