5-tert-butyl-2,4-diethyl-1H-pyrazol-3-one

Systemtic Name: 5-tert-butyl-2,4-diethyl-1H-pyrazol-3-one Openeye Name: 5-tert-butyl-2,4-diethyl-1H-pyrazol-3-one CAS Name: 5-tert-butyl-2,4-diethyl-1H-pyrazol-3-one IUPAC Name: 5-tert-butyl-2,4-diethyl-1H-pyrazol-3-one Traditional Name: 5-tert-butyl-2,4-diethyl-3-pyrazolin-3-one Formula: C11H20N2O MolecularWeight: 196.2893

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NN(C1=O)CC)C(C)(C)C

Isomeric SMILES

CCC1=C(NN(C1=O)CC)C(C)(C)C

InChI

InChI=1S/C11H20N2O/c1-6-8-9(11(3,4)5)12-13(7-2)10(8)14/h12H,6-7H2,1-5H3