tert-butyl 3-methyl-5-oxidanylidene-1H-pyrazole-2-carboxylate

Systemtic Name: tert-butyl 3-methyl-5-oxidanylidene-1H-pyrazole-2-carboxylate Openeye Name: tert-butyl 3-methyl-5-oxo-1H-pyrazole-2-carboxylate CAS Name: 3-methyl-5-oxo-1H-pyrazole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-methyl-5-oxo-1H-pyrazole-2-carboxylate Traditional Name: 3-keto-5-methyl-3-pyrazoline-1-carboxylic acid tert-butyl ester Formula: C9H14N2O3 MolecularWeight: 198.21906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H14N2O3/c1-6-5-7(12)10-11(6)8(13)14-9(2,3)4/h5H,1-4H3,(H,10,12)