[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl] 4-oxidanyl-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylate

Systemtic Name: [2-(1H-indol-3-yl)-2-oxidanylidene-ethyl] 4-oxidanyl-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Openeye Name: [2-(1H-indol-3-yl)-2-oxo-ethyl] 4-hydroxy-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylate CAS Name: 4-hydroxy-1-[2-(trifluoromethyl)phenyl]-3-pyrazolecarboxylic acid [2-(1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(1H-indol-3-yl)-2-oxoethyl] 4-hydroxy-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Traditional Name: 4-hydroxy-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid [2-(1H-indol-3-yl)-2-keto-ethyl] ester Formula: C21H14F3N3O4 MolecularWeight: 429.34877

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C(=O)COC(=O)C3=NN(C=C3O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C(=O)COC(=O)C3=NN(C=C3O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H14F3N3O4/c22-21(23,24)14-6-2-4-8-16(14)27-10-17(28)19(26-27)20(30)31-11-18(29)13-9-25-15-7-3-1-5-12(13)15/h1-10,25,28H,11H2