4-[(2S)-3-[[4-cyano-3-(trifluoromethyl)phenyl]amino]-2-methyl-2-oxidanyl-3-oxidanylidene-propoxy]benzenesulfonyl fluoride

Systemtic Name: 4-[(2S)-3-[[4-cyano-3-(trifluoromethyl)phenyl]amino]-2-methyl-2-oxidanyl-3-oxidanylidene-propoxy]benzenesulfonyl fluoride Openeye Name: 4-[(2S)-3-[4-cyano-3-(trifluoromethyl)anilino]-2-hydroxy-2-methyl-3-oxo-propoxy]benzenesulfonyl fluoride CAS Name: 4-[(2S)-3-[4-cyano-3-(trifluoromethyl)anilino]-2-hydroxy-2-methyl-3-oxopropoxy]benzenesulfonyl fluoride IUPAC Name: 4-[(2S)-3-[4-cyano-3-(trifluoromethyl)anilino]-2-hydroxy-2-methyl-3-oxopropoxy]benzenesulfonyl fluoride Traditional Name: 4-[(2S)-3-[4-cyano-3-(trifluoromethyl)anilino]-2-hydroxy-3-keto-2-methyl-propoxy]benzenesulfonyl fluoride Formula: C18H14F4N2O5S MolecularWeight: 446.372773

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=C(C=C1)S(=O)(=O)F)(C(=O)NC2=CC(=C(C=C2)C#N)C(F)(F)F)O

Isomeric SMILES

C[C@](COC1=CC=C(C=C1)S(=O)(=O)F)(C(=O)NC2=CC(=C(C=C2)C#N)C(F)(F)F)O

InChI

InChI=1S/C18H14F4N2O5S/c1-17(26,10-29-13-4-6-14(7-5-13)30(22,27)28)16(25)24-12-3-2-11(9-23)15(8-12)18(19,20)21/h2-8,26H,10H2,1H3,(H,24,25)/t17-/m0/s1