1,4,5-trimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 1,4,5-trimethyl-2-phenyl-pyrazol-3-one Openeye Name: 1,4,5-trimethyl-2-phenyl-pyrazol-3-one CAS Name: 1,4,5-trimethyl-2-phenyl-3-pyrazolone IUPAC Name: 1,4,5-trimethyl-2-phenylpyrazol-3-one Traditional Name: 1,4,5-trimethyl-2-phenyl-3-pyrazolin-3-one Formula: C12H14N2O MolecularWeight: 202.25236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N(C1=O)C2=CC=CC=C2)C)C

Isomeric SMILES

CC1=C(N(N(C1=O)C2=CC=CC=C2)C)C

InChI

InChI=1S/C12H14N2O/c1-9-10(2)13(3)14(12(9)15)11-7-5-4-6-8-11/h4-8H,1-3H3