5-(3,4-dimethylphenyl)-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 5-(3,4-dimethylphenyl)-2-phenyl-4H-pyrazol-3-one Openeye Name: 5-(3,4-dimethylphenyl)-2-phenyl-4H-pyrazol-3-one CAS Name: 5-(3,4-dimethylphenyl)-2-phenyl-4H-pyrazol-3-one IUPAC Name: 5-(3,4-dimethylphenyl)-2-phenyl-4H-pyrazol-3-one Traditional Name: 5-(3,4-dimethylphenyl)-2-phenyl-2-pyrazolin-3-one Formula: C17H16N2O MolecularWeight: 264.32174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C2)C3=CC=CC=C3)C

InChI

InChI=1S/C17H16N2O/c1-12-8-9-14(10-13(12)2)16-11-17(20)19(18-16)15-6-4-3-5-7-15/h3-10H,11H2,1-2H3