5-methyl-2-phenyl-4-propan-2-ylidene-pyrazol-3-one

Systemtic Name: 5-methyl-2-phenyl-4-propan-2-ylidene-pyrazol-3-one Openeye Name: 4-isopropylidene-5-methyl-2-phenyl-pyrazol-3-one CAS Name: 5-methyl-2-phenyl-4-propan-2-ylidene-3-pyrazolone IUPAC Name: 5-methyl-2-phenyl-4-propan-2-ylidenepyrazol-3-one Traditional Name: 4-isopropylidene-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C13H14N2O MolecularWeight: 214.26306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O/c1-9(2)12-10(3)14-15(13(12)16)11-7-5-4-6-8-11/h4-8H,1-3H3