methyl 5-tert-butyl-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: methyl 5-tert-butyl-1-phenyl-pyrazole-4-carboxylate Openeye Name: methyl 5-tert-butyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-tert-butyl-1-phenyl-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-tert-butyl-1-phenylpyrazole-4-carboxylate Traditional Name: 5-tert-butyl-1-phenyl-pyrazole-4-carboxylic acid methyl ester Formula: C15H18N2O2 MolecularWeight: 258.31562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=NN1C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=C(C=NN1C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C15H18N2O2/c1-15(2,3)13-12(14(18)19-4)10-16-17(13)11-8-6-5-7-9-11/h5-10H,1-4H3