3-(4-methylphenyl)-1H-pyrazole-4,5-dione

Systemtic Name: 3-(4-methylphenyl)-1H-pyrazole-4,5-dione Openeye Name: 3-(p-tolyl)-1H-pyrazole-4,5-dione CAS Name: 3-(4-methylphenyl)-1H-pyrazole-4,5-dione IUPAC Name: 3-(4-methylphenyl)-1H-pyrazole-4,5-dione Traditional Name: 5-(p-tolyl)-2-pyrazoline-3,4-quinone Formula: C10H8N2O2 MolecularWeight: 188.18272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H8N2O2/c1-6-2-4-7(5-3-6)8-9(13)10(14)12-11-8/h2-5H,1H3,(H,12,13,14)