(4E)-2,5-dimethyl-4-(phenylazanylmethylidene)pyrazol-3-one

Systemtic Name: (4E)-2,5-dimethyl-4-(phenylazanylmethylidene)pyrazol-3-one Openeye Name: (4E)-4-(anilinomethylene)-2,5-dimethyl-pyrazol-3-one CAS Name: (4E)-4-(anilinomethylidene)-2,5-dimethyl-3-pyrazolone IUPAC Name: (4E)-4-(anilinomethylidene)-2,5-dimethylpyrazol-3-one Traditional Name: (4E)-4-(anilinomethylene)-2,5-dimethyl-2-pyrazolin-3-one Formula: C12H13N3O MolecularWeight: 215.25112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNC2=CC=CC=C2)C

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/NC2=CC=CC=C2)C

InChI

InChI=1S/C12H13N3O/c1-9-11(12(16)15(2)14-9)8-13-10-6-4-3-5-7-10/h3-8,13H,1-2H3/b11-8+