4-ethanoyl-2-methyl-5-phenyl-1H-pyrazol-3-one

Systemtic Name: 4-ethanoyl-2-methyl-5-phenyl-1H-pyrazol-3-one Openeye Name: 4-acetyl-2-methyl-5-phenyl-1H-pyrazol-3-one CAS Name: 4-acetyl-2-methyl-5-phenyl-1H-pyrazol-3-one IUPAC Name: 4-acetyl-2-methyl-5-phenyl-1H-pyrazol-3-one Traditional Name: 4-acetyl-2-methyl-5-phenyl-3-pyrazolin-3-one Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(NN(C1=O)C)C2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=C(NN(C1=O)C)C2=CC=CC=C2

InChI

InChI=1S/C12H12N2O2/c1-8(15)10-11(13-14(2)12(10)16)9-6-4-3-5-7-9/h3-7,13H,1-2H3