5-tert-butyl-2-methyl-4H-pyrazol-3-one

Systemtic Name: 5-tert-butyl-2-methyl-4H-pyrazol-3-one Openeye Name: 5-tert-butyl-2-methyl-4H-pyrazol-3-one CAS Name: 5-tert-butyl-2-methyl-4H-pyrazol-3-one IUPAC Name: 5-tert-butyl-2-methyl-4H-pyrazol-3-one Traditional Name: 5-tert-butyl-2-methyl-2-pyrazolin-3-one Formula: C8H14N2O MolecularWeight: 154.20956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=O)C1)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=O)C1)C

InChI

InChI=1S/C8H14N2O/c1-8(2,3)6-5-7(11)10(4)9-6/h5H2,1-4H3