[2-(4-methylphenyl)-5-propyl-pyrazol-3-yl] 3,5-bis(chloranyl)benzoate

Systemtic Name: [2-(4-methylphenyl)-5-propyl-pyrazol-3-yl] 3,5-bis(chloranyl)benzoate Openeye Name: [5-propyl-2-(p-tolyl)pyrazol-3-yl] 3,5-dichlorobenzoate CAS Name: 3,5-dichlorobenzoic acid [2-(4-methylphenyl)-5-propyl-3-pyrazolyl] ester IUPAC Name: [2-(4-methylphenyl)-5-propylpyrazol-3-yl] 3,5-dichlorobenzoate Traditional Name: 3,5-dichlorobenzoic acid [5-propyl-2-(p-tolyl)pyrazol-3-yl] ester Formula: C20H18Cl2N2O2 MolecularWeight: 389.27512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18Cl2N2O2/c1-3-4-17-12-19(24(23-17)18-7-5-13(2)6-8-18)26-20(25)14-9-15(21)11-16(22)10-14/h5-12H,3-4H2,1-2H3