ethyl 5-tert-butyl-1-(2,4-dichlorophenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 5-tert-butyl-1-(2,4-dichlorophenyl)pyrazole-3-carboxylate Openeye Name: ethyl 5-tert-butyl-1-(2,4-dichlorophenyl)pyrazole-3-carboxylate CAS Name: 5-tert-butyl-1-(2,4-dichlorophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-tert-butyl-1-(2,4-dichlorophenyl)pyrazole-3-carboxylate Traditional Name: 5-tert-butyl-1-(2,4-dichlorophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C16H18Cl2N2O2 MolecularWeight: 341.23232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C(C)(C)C)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C(C)(C)C)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H18Cl2N2O2/c1-5-22-15(21)12-9-14(16(2,3)4)20(19-12)13-7-6-10(17)8-11(13)18/h6-9H,5H2,1-4H3