[2-[[3-oxidanylidene-3-(3-pyridin-3-ylphenyl)propanoyl]amino]-4-(trifluoromethyl)-5-[2,2,2-tris(fluoranyl)ethoxy]phenyl]carbamic acid

Systemtic Name: [2-[[3-oxidanylidene-3-(3-pyridin-3-ylphenyl)propanoyl]amino]-4-(trifluoromethyl)-5-[2,2,2-tris(fluoranyl)ethoxy]phenyl]carbamic acid Openeye Name: [2-[[3-oxo-3-[3-(3-pyridyl)phenyl]propanoyl]amino]-5-(2,2,2-trifluoroethoxy)-4-(trifluoromethyl)phenyl]carbamic acid CAS Name: [2-[[1,3-dioxo-3-[3-(3-pyridinyl)phenyl]propyl]amino]-5-(2,2,2-trifluoroethoxy)-4-(trifluoromethyl)phenyl]carbamic acid IUPAC Name: [2-[[3-oxo-3-(3-pyridin-3-ylphenyl)propanoyl]amino]-5-(2,2,2-trifluoroethoxy)-4-(trifluoromethyl)phenyl]carbamic acid Traditional Name: [2-[[3-keto-3-[3-(3-pyridyl)phenyl]propanoyl]amino]-5-(2,2,2-trifluoroethoxy)-4-(trifluoromethyl)phenyl]carbamic acid Formula: C24H17F6N3O5 MolecularWeight: 541.399299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)CC(=O)NC2=C(C=C(C(=C2)C(F)(F)F)OCC(F)(F)F)NC(=O)O)C3=CN=CC=C3

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)CC(=O)NC2=C(C=C(C(=C2)C(F)(F)F)OCC(F)(F)F)NC(=O)O)C3=CN=CC=C3

InChI

InChI=1S/C24H17F6N3O5/c25-23(26,27)12-38-20-9-18(33-22(36)37)17(8-16(20)24(28,29)30)32-21(35)10-19(34)14-4-1-3-13(7-14)15-5-2-6-31-11-15/h1-9,11,33H,10,12H2,(H,32,35)(H,36,37)