bis[2,2,2-tris(fluoranyl)ethyl] 2-[(4-methoxyphenyl)carbamoyl]propanedioate

Systemtic Name: bis[2,2,2-tris(fluoranyl)ethyl] 2-[(4-methoxyphenyl)carbamoyl]propanedioate Openeye Name: bis(2,2,2-trifluoroethyl) 2-[(4-methoxyphenyl)carbamoyl]propanedioate CAS Name: 2-[(4-methoxyanilino)-oxomethyl]propanedioic acid bis(2,2,2-trifluoroethyl) ester IUPAC Name: bis(2,2,2-trifluoroethyl) 2-[(4-methoxyphenyl)carbamoyl]propanedioate Traditional Name: 2-[(4-methoxyphenyl)carbamoyl]malonic acid bis(2,2,2-trifluoroethyl) ester Formula: C15H13F6NO6 MolecularWeight: 417.257239

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(C(=O)OCC(F)(F)F)C(=O)OCC(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C(C(=O)OCC(F)(F)F)C(=O)OCC(F)(F)F

InChI

InChI=1S/C15H13F6NO6/c1-26-9-4-2-8(3-5-9)22-11(23)10(12(24)27-6-14(16,17)18)13(25)28-7-15(19,20)21/h2-5,10H,6-7H2,1H3,(H,22,23)