5-methyl-2-phenyl-4-propanoyl-pyrazol-3-olate

Systemtic Name: 5-methyl-2-phenyl-4-propanoyl-pyrazol-3-olate Openeye Name: 5-methyl-2-phenyl-4-propanoyl-pyrazol-3-olate CAS Name: 5-methyl-4-(1-oxopropyl)-2-phenyl-3-pyrazololate IUPAC Name: 5-methyl-2-phenyl-4-propanoylpyrazol-3-olate Traditional Name: 5-methyl-2-phenyl-4-propionyl-pyrazol-3-olate Formula: C13H13N2O2- MolecularWeight: 229.25452

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(N(N=C1C)C2=CC=CC=C2)[O-]

Isomeric SMILES

CCC(=O)C1=C(N(N=C1C)C2=CC=CC=C2)[O-]

InChI

InChI=1S/C13H14N2O2/c1-3-11(16)12-9(2)14-15(13(12)17)10-7-5-4-6-8-10/h4-8,17H,3H2,1-2H3/p-1