4-ethyl-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-ethyl-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-ethyl-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-ethyl-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-ethyl-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-ethyl-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C13H16N2O MolecularWeight: 216.27894

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(N(C1=O)C2=CC=CC=C2)C)C

Isomeric SMILES

CCC1=C(N(N(C1=O)C2=CC=CC=C2)C)C

InChI

InChI=1S/C13H16N2O/c1-4-12-10(2)14(3)15(13(12)16)11-8-6-5-7-9-11/h5-9H,4H2,1-3H3