4-butyl-5-methyl-pyrazol-3-one

Systemtic Name: 4-butyl-5-methyl-pyrazol-3-one Openeye Name: 4-butyl-5-methyl-pyrazol-3-one CAS Name: 4-butyl-5-methyl-3-pyrazolone IUPAC Name: 4-butyl-5-methylpyrazol-3-one Traditional Name: 4-butyl-5-methyl-pyrazol-3-one Formula: C8H12N2O MolecularWeight: 152.19368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=NC1=O)C

Isomeric SMILES

CCCCC1=C(N=NC1=O)C

InChI

InChI=1S/C8H12N2O/c1-3-4-5-7-6(2)9-10-8(7)11/h3-5H2,1-2H3