methyl 3,3,3-tris(fluoranyl)-2-[4-[methyl(phenylsulfonyl)amino]phenyl]-2-oxidanyl-propanoate

Systemtic Name: methyl 3,3,3-tris(fluoranyl)-2-[4-[methyl(phenylsulfonyl)amino]phenyl]-2-oxidanyl-propanoate Openeye Name: methyl 2-[4-[benzenesulfonyl(methyl)amino]phenyl]-3,3,3-trifluoro-2-hydroxy-propanoate CAS Name: 2-[4-[benzenesulfonyl(methyl)amino]phenyl]-3,3,3-trifluoro-2-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-[4-[benzenesulfonyl(methyl)amino]phenyl]-3,3,3-trifluoro-2-hydroxypropanoate Traditional Name: 2-[4-[besyl(methyl)amino]phenyl]-3,3,3-trifluoro-2-hydroxy-propionic acid methyl ester Formula: C17H16F3NO5S MolecularWeight: 403.37285

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)C(C(=O)OC)(C(F)(F)F)O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CN(C1=CC=C(C=C1)C(C(=O)OC)(C(F)(F)F)O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H16F3NO5S/c1-21(27(24,25)14-6-4-3-5-7-14)13-10-8-12(9-11-13)16(23,15(22)26-2)17(18,19)20/h3-11,23H,1-2H3