[4-(4-acetamidophenyl)-2-(4-fluorophenyl)-5-(2-methylpropyl)pyrazol-3-yl] ethanoate

Systemtic Name: [4-(4-acetamidophenyl)-2-(4-fluorophenyl)-5-(2-methylpropyl)pyrazol-3-yl] ethanoate Openeye Name: [4-(4-acetamidophenyl)-2-(4-fluorophenyl)-5-isobutyl-pyrazol-3-yl] acetate CAS Name: acetic acid [4-(4-acetamidophenyl)-2-(4-fluorophenyl)-5-(2-methylpropyl)-3-pyrazolyl] ester IUPAC Name: [4-(4-acetamidophenyl)-2-(4-fluorophenyl)-5-(2-methylpropyl)pyrazol-3-yl] acetate Traditional Name: acetic acid [4-(4-acetamidophenyl)-2-(4-fluorophenyl)-5-isobutyl-pyrazol-3-yl] ester Formula: C23H24FN3O3 MolecularWeight: 409.453363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN(C(=C1C2=CC=C(C=C2)NC(=O)C)OC(=O)C)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CC1=NN(C(=C1C2=CC=C(C=C2)NC(=O)C)OC(=O)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H24FN3O3/c1-14(2)13-21-22(17-5-9-19(10-6-17)25-15(3)28)23(30-16(4)29)27(26-21)20-11-7-18(24)8-12-20/h5-12,14H,13H2,1-4H3,(H,25,28)