[2-(2,3-dimethylphenyl)-5-propyl-pyrazol-3-yl] 4-ethylbenzoate

Systemtic Name: [2-(2,3-dimethylphenyl)-5-propyl-pyrazol-3-yl] 4-ethylbenzoate Openeye Name: [2-(2,3-dimethylphenyl)-5-propyl-pyrazol-3-yl] 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid [2-(2,3-dimethylphenyl)-5-propyl-3-pyrazolyl] ester IUPAC Name: [2-(2,3-dimethylphenyl)-5-propylpyrazol-3-yl] 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid [2-(2,3-dimethylphenyl)-5-propyl-pyrazol-3-yl] ester Formula: C23H26N2O2 MolecularWeight: 362.46474

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1)OC(=O)C2=CC=C(C=C2)CC)C3=CC=CC(=C3C)C

Isomeric SMILES

CCCC1=NN(C(=C1)OC(=O)C2=CC=C(C=C2)CC)C3=CC=CC(=C3C)C

InChI

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