ethyl 2-[4-[[3-ethoxy-1,1,1-tris(fluoranyl)-3-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethoxy]propan-2-yl]carbamoylamino]-3-methyl-phenyl]-3,3,3-tris(fluoranyl)-2-oxidanyl-propanoate

Systemtic Name: ethyl 2-[4-[[3-ethoxy-1,1,1-tris(fluoranyl)-3-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethoxy]propan-2-yl]carbamoylamino]-3-methyl-phenyl]-3,3,3-tris(fluoranyl)-2-oxidanyl-propanoate Openeye Name: ethyl 2-[4-[[1-ethoxycarbonyl-2,2,2-trifluoro-1-(2,2,2-trifluoroethoxy)ethyl]carbamoylamino]-3-methyl-phenyl]-3,3,3-trifluoro-2-hydroxy-propanoate CAS Name: 2-[4-[[[[3-ethoxy-1,1,1-trifluoro-3-oxo-2-(2,2,2-trifluoroethoxy)propan-2-yl]amino]-oxomethyl]amino]-3-methylphenyl]-3,3,3-trifluoro-2-hydroxypropanoic acid ethyl ester IUPAC Name: ethyl 2-[4-[[3-ethoxy-1,1,1-trifluoro-3-oxo-2-(2,2,2-trifluoroethoxy)propan-2-yl]carbamoylamino]-3-methylphenyl]-3,3,3-trifluoro-2-hydroxypropanoate Traditional Name: 2-[4-[[1-carbethoxy-2,2,2-trifluoro-1-(2,2,2-trifluoroethoxy)ethyl]carbamoylamino]-3-methyl-phenyl]-3,3,3-trifluoro-2-hydroxy-propionic acid ethyl ester Formula: C20H21F9N2O7 MolecularWeight: 572.375569

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC(=C(C=C1)NC(=O)NC(C(=O)OCC)(C(F)(F)F)OCC(F)(F)F)C)(C(F)(F)F)O

Isomeric SMILES

CCOC(=O)C(C1=CC(=C(C=C1)NC(=O)NC(C(=O)OCC)(C(F)(F)F)OCC(F)(F)F)C)(C(F)(F)F)O

InChI

InChI=1S/C20H21F9N2O7/c1-4-36-13(32)17(35,19(24,25)26)11-6-7-12(10(3)8-11)30-15(34)31-18(20(27,28)29,14(33)37-5-2)38-9-16(21,22)23/h6-8,35H,4-5,9H2,1-3H3,(H2,30,31,34)