[4-(4-fluorophenyl)carbonylphenyl] 3-(1,3,5-trimethylpyrazol-4-yl)propanoate

Systemtic Name: [4-(4-fluorophenyl)carbonylphenyl] 3-(1,3,5-trimethylpyrazol-4-yl)propanoate Openeye Name: [4-(4-fluorobenzoyl)phenyl] 3-(1,3,5-trimethylpyrazol-4-yl)propanoate CAS Name: 3-(1,3,5-trimethyl-4-pyrazolyl)propanoic acid [4-[(4-fluorophenyl)-oxomethyl]phenyl] ester IUPAC Name: [4-(4-fluorobenzoyl)phenyl] 3-(1,3,5-trimethylpyrazol-4-yl)propanoate Traditional Name: 3-(1,3,5-trimethylpyrazol-4-yl)propionic acid [4-(4-fluorobenzoyl)phenyl] ester Formula: C22H21FN2O3 MolecularWeight: 380.412143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CCC(=O)OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C(=NN1C)C)CCC(=O)OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H21FN2O3/c1-14-20(15(2)25(3)24-14)12-13-21(26)28-19-10-6-17(7-11-19)22(27)16-4-8-18(23)9-5-16/h4-11H,12-13H2,1-3H3