[2-(2,4-dimethylphenyl)-5-ethyl-pyrazol-3-yl] 2-phenylbutanoate

Systemtic Name: [2-(2,4-dimethylphenyl)-5-ethyl-pyrazol-3-yl] 2-phenylbutanoate Openeye Name: [2-(2,4-dimethylphenyl)-5-ethyl-pyrazol-3-yl] 2-phenylbutanoate CAS Name: 2-phenylbutanoic acid [2-(2,4-dimethylphenyl)-5-ethyl-3-pyrazolyl] ester IUPAC Name: [2-(2,4-dimethylphenyl)-5-ethylpyrazol-3-yl] 2-phenylbutanoate Traditional Name: 2-phenylbutyric acid [2-(2,4-dimethylphenyl)-5-ethyl-pyrazol-3-yl] ester Formula: C23H26N2O2 MolecularWeight: 362.46474

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)OC(=O)C(CC)C2=CC=CC=C2)C3=C(C=C(C=C3)C)C

Isomeric SMILES

CCC1=NN(C(=C1)OC(=O)C(CC)C2=CC=CC=C2)C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C23H26N2O2/c1-5-19-15-22(25(24-19)21-13-12-16(3)14-17(21)4)27-23(26)20(6-2)18-10-8-7-9-11-18/h7-15,20H,5-6H2,1-4H3