ethyl 3,3,3-tris(fluoranyl)-2-(phenylsulfonylamino)-2-(pyridin-2-ylamino)propanoate

Systemtic Name: ethyl 3,3,3-tris(fluoranyl)-2-(phenylsulfonylamino)-2-(pyridin-2-ylamino)propanoate Openeye Name: ethyl 2-(benzenesulfonamido)-3,3,3-trifluoro-2-(2-pyridylamino)propanoate CAS Name: 2-(benzenesulfonamido)-3,3,3-trifluoro-2-(2-pyridinylamino)propanoic acid ethyl ester IUPAC Name: ethyl 2-(benzenesulfonamido)-3,3,3-trifluoro-2-(pyridin-2-ylamino)propanoate Traditional Name: 2-(benzenesulfonamido)-3,3,3-trifluoro-2-(2-pyridylamino)propionic acid ethyl ester Formula: C16H16F3N3O4S MolecularWeight: 403.37615

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(F)(F)F)(NC1=CC=CC=N1)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C(F)(F)F)(NC1=CC=CC=N1)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H16F3N3O4S/c1-2-26-14(23)15(16(17,18)19,21-13-10-6-7-11-20-13)22-27(24,25)12-8-4-3-5-9-12/h3-11,22H,2H2,1H3,(H,20,21)