[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 2-[4-(trifluoromethyl)phenyl]benzoate

Systemtic Name: [2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 2-[4-(trifluoromethyl)phenyl]benzoate Openeye Name: [2-(2-furylmethylamino)-2-oxo-ethyl] 2-[4-(trifluoromethyl)phenyl]benzoate CAS Name: 2-[4-(trifluoromethyl)phenyl]benzoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylamino)-2-oxoethyl] 2-[4-(trifluoromethyl)phenyl]benzoate Traditional Name: 2-[4-(trifluoromethyl)phenyl]benzoic acid [2-(2-furfurylamino)-2-keto-ethyl] ester Formula: C21H16F3NO4 MolecularWeight: 403.35125

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)C(F)(F)F)C(=O)OCC(=O)NCC3=CC=CO3

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)C(F)(F)F)C(=O)OCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C21H16F3NO4/c22-21(23,24)15-9-7-14(8-10-15)17-5-1-2-6-18(17)20(27)29-13-19(26)25-12-16-4-3-11-28-16/h1-11H,12-13H2,(H,25,26)