5-tert-butyl-1-methyl-pyrazole-3-carboxylate

Systemtic Name: 5-tert-butyl-1-methyl-pyrazole-3-carboxylate Openeye Name: 5-tert-butyl-1-methyl-pyrazole-3-carboxylate CAS Name: 5-tert-butyl-1-methyl-3-pyrazolecarboxylate IUPAC Name: 5-tert-butyl-1-methylpyrazole-3-carboxylate Traditional Name: 5-tert-butyl-1-methyl-pyrazole-3-carboxylate Formula: C9H13N2O2- MolecularWeight: 181.21172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1C)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=NN1C)C(=O)[O-]

InChI

InChI=1S/C9H14N2O2/c1-9(2,3)7-5-6(8(12)13)10-11(7)4/h5H,1-4H3,(H,12,13)/p-1