phenacyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate

Systemtic Name: phenacyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate Openeye Name: phenacyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate CAS Name: 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoic acid phenacyl ester IUPAC Name: phenacyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate Traditional Name: 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propionic acid phenacyl ester Formula: C18H16F3NO5S MolecularWeight: 415.38355

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)CCNS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)CCNS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C18H16F3NO5S/c19-18(20,21)14-7-4-8-15(11-14)28(25,26)22-10-9-17(24)27-12-16(23)13-5-2-1-3-6-13/h1-8,11,22H,9-10,12H2