methyl (2S)-2-acetamido-2-[4-(trifluoromethylsulfonyloxy)phenyl]ethanoate

Systemtic Name: methyl (2S)-2-acetamido-2-[4-(trifluoromethylsulfonyloxy)phenyl]ethanoate Openeye Name: methyl (2S)-2-acetamido-2-[4-(trifluoromethylsulfonyloxy)phenyl]acetate CAS Name: (2S)-2-acetamido-2-[4-(trifluoromethylsulfonyloxy)phenyl]acetic acid methyl ester IUPAC Name: methyl (2S)-2-acetamido-2-[4-(trifluoromethylsulfonyloxy)phenyl]acetate Traditional Name: (2S)-2-acetamido-2-(4-triflyloxyphenyl)acetic acid methyl ester Formula: C12H12F3NO6S MolecularWeight: 355.28699

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F)C(=O)OC

Isomeric SMILES

CC(=O)N[C@@H](C1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F)C(=O)OC

InChI

InChI=1S/C12H12F3NO6S/c1-7(17)16-10(11(18)21-2)8-3-5-9(6-4-8)22-23(19,20)12(13,14)15/h3-6,10H,1-2H3,(H,16,17)/t10-/m0/s1