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

Systemtic Name: [2,6-bis(pentanoylamino)pyridin-4-yl] tris(fluoranyl)methanesulfonate Openeye Name: [2,6-bis(pentanoylamino)-4-pyridyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2,6-bis(1-oxopentylamino)-4-pyridinyl] ester IUPAC Name: [2,6-bis(pentanoylamino)pyridin-4-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2,6-bis(valerylamino)-4-pyridyl] ester Formula: C16H22F3N3O5S MolecularWeight: 425.42319

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=CC(=N1)NC(=O)CCCC)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCCCC(=O)NC1=CC(=CC(=N1)NC(=O)CCCC)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C16H22F3N3O5S/c1-3-5-7-14(23)21-12-9-11(27-28(25,26)16(17,18)19)10-13(20-12)22-15(24)8-6-4-2/h9-10H,3-8H2,1-2H3,(H2,20,21,22,23,24)