ethyl 1-(3-cyano-4-fluoranyl-phenyl)-5-(furan-2-yl)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(3-cyano-4-fluoranyl-phenyl)-5-(furan-2-yl)pyrazole-4-carboxylate Openeye Name: ethyl 1-(3-cyano-4-fluoro-phenyl)-5-(2-furyl)pyrazole-4-carboxylate CAS Name: 1-(3-cyano-4-fluorophenyl)-5-(2-furanyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-cyano-4-fluorophenyl)-5-(furan-2-yl)pyrazole-4-carboxylate Traditional Name: 1-(3-cyano-4-fluoro-phenyl)-5-(2-furyl)pyrazole-4-carboxylic acid ethyl ester Formula: C17H12FN3O3 MolecularWeight: 325.293883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=C(C=C2)F)C#N)C3=CC=CO3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=C(C=C2)F)C#N)C3=CC=CO3

InChI

InChI=1S/C17H12FN3O3/c1-2-23-17(22)13-10-20-21(16(13)15-4-3-7-24-15)12-5-6-14(18)11(8-12)9-19/h3-8,10H,2H2,1H3