[2-[[2,5-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: [2-[[2,5-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: [2-(2,5-difluoroanilino)-2-oxo-ethyl] 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-(2,5-difluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-difluoroanilino)-2-oxoethyl] 1-(4-fluorophenyl)-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylic acid [2-(2,5-difluoroanilino)-2-keto-ethyl] ester Formula: C21H17F3N2O3 MolecularWeight: 402.36649

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C(=O)OCC(=O)NC3=C(C=CC(=C3)F)F

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C(=O)OCC(=O)NC3=C(C=CC(=C3)F)F

InChI

InChI=1S/C21H17F3N2O3/c1-12-9-17(13(2)26(12)16-6-3-14(22)4-7-16)21(28)29-11-20(27)25-19-10-15(23)5-8-18(19)24/h3-10H,11H2,1-2H3,(H,25,27)