[2-[[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-pyrazol-1-ylbenzoate

Systemtic Name: [2-[[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-pyrazol-1-ylbenzoate Openeye Name: [2-[2-(2-methoxyethoxy)-5-(trifluoromethyl)anilino]-2-oxo-ethyl] 4-pyrazol-1-ylbenzoate CAS Name: 4-(1-pyrazolyl)benzoic acid [2-[2-(2-methoxyethoxy)-5-(trifluoromethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2-methoxyethoxy)-5-(trifluoromethyl)anilino]-2-oxoethyl] 4-pyrazol-1-ylbenzoate Traditional Name: 4-pyrazol-1-ylbenzoic acid [2-keto-2-[2-(2-methoxyethoxy)-5-(trifluoromethyl)anilino]ethyl] ester Formula: C22H20F3N3O5 MolecularWeight: 463.40651

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)COC(=O)C2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)COC(=O)C2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C22H20F3N3O5/c1-31-11-12-32-19-8-5-16(22(23,24)25)13-18(19)27-20(29)14-33-21(30)15-3-6-17(7-4-15)28-10-2-9-26-28/h2-10,13H,11-12,14H2,1H3,(H,27,29)