[5-tert-butyl-2-(3-fluorophenyl)pyrazol-3-yl] 4-butylbenzoate

Systemtic Name: [5-tert-butyl-2-(3-fluorophenyl)pyrazol-3-yl] 4-butylbenzoate Openeye Name: [5-tert-butyl-2-(3-fluorophenyl)pyrazol-3-yl] 4-butylbenzoate CAS Name: 4-butylbenzoic acid [5-tert-butyl-2-(3-fluorophenyl)-3-pyrazolyl] ester IUPAC Name: [5-tert-butyl-2-(3-fluorophenyl)pyrazol-3-yl] 4-butylbenzoate Traditional Name: 4-butylbenzoic acid [5-tert-butyl-2-(3-fluorophenyl)pyrazol-3-yl] ester Formula: C24H27FN2O2 MolecularWeight: 394.481783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC(=CC=C3)F)C(C)(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC(=CC=C3)F)C(C)(C)C

InChI

InChI=1S/C24H27FN2O2/c1-5-6-8-17-11-13-18(14-12-17)23(28)29-22-16-21(24(2,3)4)26-27(22)20-10-7-9-19(25)15-20/h7,9-16H,5-6,8H2,1-4H3