ethyl 2-acetamido-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoate

Systemtic Name: ethyl 2-acetamido-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoate Openeye Name: ethyl 2-acetamido-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoate CAS Name: 2-acetamido-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-acetamido-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoate Traditional Name: 2-acetamido-3-(4-triflyloxyphenyl)propionic acid ethyl ester Formula: C14H16F3NO6S MolecularWeight: 383.34015

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F)NC(=O)C

InChI

InChI=1S/C14H16F3NO6S/c1-3-23-13(20)12(18-9(2)19)8-10-4-6-11(7-5-10)24-25(21,22)14(15,16)17/h4-7,12H,3,8H2,1-2H3,(H,18,19)