[2-[5-(4-chlorophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl] 4-(4-fluorophenyl)-4-oxidanylidene-butanoate

Systemtic Name: [2-[5-(4-chlorophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl] 4-(4-fluorophenyl)-4-oxidanylidene-butanoate Openeye Name: [2-[5-(4-chlorophenyl)-3-(2-furyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl] 4-(4-fluorophenyl)-4-oxo-butanoate CAS Name: 4-(4-fluorophenyl)-4-oxobutanoic acid [2-[5-(4-chlorophenyl)-3-(2-furanyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl] ester IUPAC Name: [2-[5-(4-chlorophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl] 4-(4-fluorophenyl)-4-oxobutanoate Traditional Name: 4-(4-fluorophenyl)-4-keto-butyric acid [2-[3-(4-chlorophenyl)-5-(2-furyl)-2-pyrazolin-1-yl]-2-keto-ethyl] ester Formula: C25H20ClFN2O5 MolecularWeight: 482.888103

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=C(C=C2)Cl)C(=O)COC(=O)CCC(=O)C3=CC=C(C=C3)F)C4=CC=CO4

Isomeric SMILES

C1C(N(N=C1C2=CC=C(C=C2)Cl)C(=O)COC(=O)CCC(=O)C3=CC=C(C=C3)F)C4=CC=CO4

InChI

InChI=1S/C25H20ClFN2O5/c26-18-7-3-16(4-8-18)20-14-21(23-2-1-13-33-23)29(28-20)24(31)15-34-25(32)12-11-22(30)17-5-9-19(27)10-6-17/h1-10,13,21H,11-12,14-15H2