methyl 3-(4-tert-butylphenyl)-1H-pyrazole-5-carboxylate

Systemtic Name: methyl 3-(4-tert-butylphenyl)-1H-pyrazole-5-carboxylate Openeye Name: methyl 3-(4-tert-butylphenyl)-1H-pyrazole-5-carboxylate CAS Name: 3-(4-tert-butylphenyl)-1H-pyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-(4-tert-butylphenyl)-1H-pyrazole-5-carboxylate Traditional Name: 3-(4-tert-butylphenyl)-1H-pyrazole-5-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=CC=C(C=C1)C2=NNC(=C2)C(=O)OC

Isomeric SMILES

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

InChI

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