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

Systemtic Name: [2-(2,3-dimethylphenyl)-5-ethyl-pyrazol-3-yl] 3-cyclopentylpropanoate Openeye Name: [2-(2,3-dimethylphenyl)-5-ethyl-pyrazol-3-yl] 3-cyclopentylpropanoate CAS Name: 3-cyclopentylpropanoic acid [2-(2,3-dimethylphenyl)-5-ethyl-3-pyrazolyl] ester IUPAC Name: [2-(2,3-dimethylphenyl)-5-ethylpyrazol-3-yl] 3-cyclopentylpropanoate Traditional Name: 3-cyclopentylpropionic acid [2-(2,3-dimethylphenyl)-5-ethyl-pyrazol-3-yl] ester Formula: C21H28N2O2 MolecularWeight: 340.45922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)OC(=O)CCC2CCCC2)C3=CC=CC(=C3C)C

Isomeric SMILES

CCC1=NN(C(=C1)OC(=O)CCC2CCCC2)C3=CC=CC(=C3C)C

InChI

InChI=1S/C21H28N2O2/c1-4-18-14-20(25-21(24)13-12-17-9-5-6-10-17)23(22-18)19-11-7-8-15(2)16(19)3/h7-8,11,14,17H,4-6,9-10,12-13H2,1-3H3