tert-butyl 5-methylpyrazole-1-carboxylate

Systemtic Name: tert-butyl 5-methylpyrazole-1-carboxylate Openeye Name: tert-butyl 5-methylpyrazole-1-carboxylate CAS Name: 5-methyl-1-pyrazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-methylpyrazole-1-carboxylate Traditional Name: 5-methylpyrazole-1-carboxylic acid tert-butyl ester Formula: C9H14N2O2 MolecularWeight: 182.21966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=NN1C(=O)OC(C)(C)C

InChI

InChI=1S/C9H14N2O2/c1-7-5-6-10-11(7)8(12)13-9(2,3)4/h5-6H,1-4H3