[2-(4-methylphenyl)-5-propyl-pyrazol-3-yl] 4-tert-butylbenzoate

Systemtic Name: [2-(4-methylphenyl)-5-propyl-pyrazol-3-yl] 4-tert-butylbenzoate Openeye Name: [5-propyl-2-(p-tolyl)pyrazol-3-yl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [2-(4-methylphenyl)-5-propyl-3-pyrazolyl] ester IUPAC Name: [2-(4-methylphenyl)-5-propylpyrazol-3-yl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [5-propyl-2-(p-tolyl)pyrazol-3-yl] ester Formula: C24H28N2O2 MolecularWeight: 376.49132

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1)OC(=O)C2=CC=C(C=C2)C(C)(C)C)C3=CC=C(C=C3)C

Isomeric SMILES

CCCC1=NN(C(=C1)OC(=O)C2=CC=C(C=C2)C(C)(C)C)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H28N2O2/c1-6-7-20-16-22(26(25-20)21-14-8-17(2)9-15-21)28-23(27)18-10-12-19(13-11-18)24(3,4)5/h8-16H,6-7H2,1-5H3