2,4,5-triphenyl-4H-pyrazol-3-one

Systemtic Name: 2,4,5-triphenyl-4H-pyrazol-3-one Openeye Name: 2,4,5-triphenyl-4H-pyrazol-3-one CAS Name: 2,4,5-triphenyl-4H-pyrazol-3-one IUPAC Name: 2,4,5-triphenyl-4H-pyrazol-3-one Traditional Name: 2,4,5-triphenyl-2-pyrazolin-3-one Formula: C21H16N2O MolecularWeight: 312.36454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(=NN(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2C(=NN(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H16N2O/c24-21-19(16-10-4-1-5-11-16)20(17-12-6-2-7-13-17)22-23(21)18-14-8-3-9-15-18/h1-15,19H