5-phenyl-2-propan-2-yl-pyrazole-3,4-dione

Systemtic Name: 5-phenyl-2-propan-2-yl-pyrazole-3,4-dione Openeye Name: 2-isopropyl-5-phenyl-pyrazole-3,4-dione CAS Name: 5-phenyl-2-propan-2-ylpyrazole-3,4-dione IUPAC Name: 5-phenyl-2-propan-2-ylpyrazole-3,4-dione Traditional Name: 2-isopropyl-5-phenyl-2-pyrazoline-3,4-quinone Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C(=O)C(=N1)C2=CC=CC=C2

Isomeric SMILES

CC(C)N1C(=O)C(=O)C(=N1)C2=CC=CC=C2

InChI

InChI=1S/C12H12N2O2/c1-8(2)14-12(16)11(15)10(13-14)9-6-4-3-5-7-9/h3-8H,1-2H3