5-ethyl-2-(2-methylpropyl)-4H-pyrazol-3-one

Systemtic Name: 5-ethyl-2-(2-methylpropyl)-4H-pyrazol-3-one Openeye Name: 5-ethyl-2-isobutyl-4H-pyrazol-3-one CAS Name: 5-ethyl-2-(2-methylpropyl)-4H-pyrazol-3-one IUPAC Name: 5-ethyl-2-(2-methylpropyl)-4H-pyrazol-3-one Traditional Name: 5-ethyl-2-isobutyl-2-pyrazolin-3-one Formula: C9H16N2O MolecularWeight: 168.23614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16N2O/c1-4-8-5-9(12)11(10-8)6-7(2)3/h7H,4-6H2,1-3H3