2-tert-butyl-5-methyl-pyrazole-3,4-dione

Systemtic Name: 2-tert-butyl-5-methyl-pyrazole-3,4-dione Openeye Name: 2-tert-butyl-5-methyl-pyrazole-3,4-dione CAS Name: 2-tert-butyl-5-methylpyrazole-3,4-dione IUPAC Name: 2-tert-butyl-5-methylpyrazole-3,4-dione Traditional Name: 2-tert-butyl-5-methyl-2-pyrazoline-3,4-quinone Formula: C8H12N2O2 MolecularWeight: 168.19308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=O)C(C)(C)C

Isomeric SMILES

CC1=NN(C(=O)C1=O)C(C)(C)C

InChI

InChI=1S/C8H12N2O2/c1-5-6(11)7(12)10(9-5)8(2,3)4/h1-4H3