2-[3-[(3E)-3-(5-oxidanylidenepyridin-2-ylidene)-1,2,4-oxadiazol-5-yl]propanoylamino]-4-[2,3,5-tris(fluoranyl)phenyl]cyclohexene-1-carboxylic acid

Systemtic Name: 2-[3-[(3E)-3-(5-oxidanylidenepyridin-2-ylidene)-1,2,4-oxadiazol-5-yl]propanoylamino]-4-[2,3,5-tris(fluoranyl)phenyl]cyclohexene-1-carboxylic acid Openeye Name: 2-[3-[(3E)-3-(5-oxo-2-pyridylidene)-1,2,4-oxadiazol-5-yl]propanoylamino]-4-(2,3,5-trifluorophenyl)cyclohexene-1-carboxylic acid CAS Name: 2-[[1-oxo-3-[(3E)-3-(5-oxo-2-pyridinylidene)-1,2,4-oxadiazol-5-yl]propyl]amino]-4-(2,3,5-trifluorophenyl)-1-cyclohexenecarboxylic acid IUPAC Name: 2-[3-[(3E)-3-(5-oxopyridin-2-ylidene)-1,2,4-oxadiazol-5-yl]propanoylamino]-4-(2,3,5-trifluorophenyl)cyclohexene-1-carboxylic acid Traditional Name: 2-[3-[(3E)-3-(5-keto-2-pyridylidene)-1,2,4-oxadiazol-5-yl]propanoylamino]-4-(2,3,5-trifluorophenyl)cyclohexene-1-carboxylic acid Formula: C23H19F3N4O5 MolecularWeight: 488.41597

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(CC1C2=CC(=CC(=C2F)F)F)NC(=O)CCC3=NC(=C4C=CC(=O)C=N4)NO3)C(=O)O

Isomeric SMILES

C1CC(=C(CC1C2=CC(=CC(=C2F)F)F)NC(=O)CCC3=N/C(=C\4/C=CC(=O)C=N4)/NO3)C(=O)O

InChI

InChI=1S/C23H19F3N4O5/c24-12-8-15(21(26)16(25)9-12)11-1-3-14(23(33)34)18(7-11)28-19(32)5-6-20-29-22(30-35-20)17-4-2-13(31)10-27-17/h2,4,8-11,30H,1,3,5-7H2,(H,28,32)(H,33,34)/b22-17+