4-butyl-3-methyl-1,4-dihydropyrazol-5-one

Systemtic Name: 4-butyl-3-methyl-1,4-dihydropyrazol-5-one Openeye Name: 4-butyl-3-methyl-1,4-dihydropyrazol-5-one CAS Name: 4-butyl-3-methyl-1,4-dihydropyrazol-5-one IUPAC Name: 4-butyl-3-methyl-1,4-dihydropyrazol-5-one Traditional Name: 4-butyl-5-methyl-2-pyrazolin-3-one Formula: C8H14N2O MolecularWeight: 154.20956

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=NNC1=O)C

Isomeric SMILES

CCCCC1C(=NNC1=O)C

InChI

InChI=1S/C8H14N2O/c1-3-4-5-7-6(2)9-10-8(7)11/h7H,3-5H2,1-2H3,(H,10,11)