ethyl 1-[2,4-bis(fluoranyl)phenyl]-4-methyl-5-pyrrol-1-yl-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-[2,4-bis(fluoranyl)phenyl]-4-methyl-5-pyrrol-1-yl-pyrazole-3-carboxylate Openeye Name: ethyl 1-(2,4-difluorophenyl)-4-methyl-5-pyrrol-1-yl-pyrazole-3-carboxylate CAS Name: 1-(2,4-difluorophenyl)-4-methyl-5-(1-pyrrolyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2,4-difluorophenyl)-4-methyl-5-pyrrol-1-ylpyrazole-3-carboxylate Traditional Name: 1-(2,4-difluorophenyl)-4-methyl-5-pyrrol-1-yl-pyrazole-3-carboxylic acid ethyl ester Formula: C17H15F2N3O2 MolecularWeight: 331.316706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1C)N2C=CC=C2)C3=C(C=C(C=C3)F)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1C)N2C=CC=C2)C3=C(C=C(C=C3)F)F

InChI

InChI=1S/C17H15F2N3O2/c1-3-24-17(23)15-11(2)16(21-8-4-5-9-21)22(20-15)14-7-6-12(18)10-13(14)19/h4-10H,3H2,1-2H3