5-tert-butyl-4-[(4-chlorophenyl)methylidene]-2-methyl-pyrazol-3-one

Systemtic Name: 5-tert-butyl-4-[(4-chlorophenyl)methylidene]-2-methyl-pyrazol-3-one Openeye Name: 5-tert-butyl-4-[(4-chlorophenyl)methylene]-2-methyl-pyrazol-3-one CAS Name: 5-tert-butyl-4-[(4-chlorophenyl)methylidene]-2-methyl-3-pyrazolone IUPAC Name: 5-tert-butyl-4-[(4-chlorophenyl)methylidene]-2-methylpyrazol-3-one Traditional Name: 5-tert-butyl-4-(4-chlorobenzylidene)-2-methyl-2-pyrazolin-3-one Formula: C15H17ClN2O MolecularWeight: 276.76128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=O)C1=CC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=O)C1=CC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C15H17ClN2O/c1-15(2,3)13-12(14(19)18(4)17-13)9-10-5-7-11(16)8-6-10/h5-9H,1-4H3