(4E)-5-methyl-4-(3-oxidanylidenebutan-2-ylidene)-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-5-methyl-4-(3-oxidanylidenebutan-2-ylidene)-2-phenyl-pyrazol-3-one Openeye Name: (4E)-5-methyl-4-(1-methyl-2-oxo-propylidene)-2-phenyl-pyrazol-3-one CAS Name: (4E)-5-methyl-4-(3-oxobutan-2-ylidene)-2-phenyl-3-pyrazolone IUPAC Name: (4E)-5-methyl-4-(3-oxobutan-2-ylidene)-2-phenylpyrazol-3-one Traditional Name: (4E)-4-(2-keto-1-methyl-propylidene)-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C14H14N2O2 MolecularWeight: 242.27316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC\1=NN(C(=O)/C1=C(\C)/C(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C14H14N2O2/c1-9(11(3)17)13-10(2)15-16(14(13)18)12-7-5-4-6-8-12/h4-8H,1-3H3/b13-9+