tert-butyl 1H-pyrazole-5-carboxylate

Systemtic Name: tert-butyl 1H-pyrazole-5-carboxylate Openeye Name: tert-butyl 1H-pyrazole-5-carboxylate CAS Name: 1H-pyrazole-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1H-pyrazole-5-carboxylate Traditional Name: 1H-pyrazole-5-carboxylic acid tert-butyl ester Formula: C8H12N2O2 MolecularWeight: 168.19308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=NN1

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=NN1

InChI

InChI=1S/C8H12N2O2/c1-8(2,3)12-7(11)6-4-5-9-10-6/h4-5H,1-3H3,(H,9,10)