2-tert-butyl-4-(4-chlorophenyl)-5-methyl-1H-pyrazol-3-one

Systemtic Name: 2-tert-butyl-4-(4-chlorophenyl)-5-methyl-1H-pyrazol-3-one Openeye Name: 2-tert-butyl-4-(4-chlorophenyl)-5-methyl-1H-pyrazol-3-one CAS Name: 2-tert-butyl-4-(4-chlorophenyl)-5-methyl-1H-pyrazol-3-one IUPAC Name: 2-tert-butyl-4-(4-chlorophenyl)-5-methyl-1H-pyrazol-3-one Traditional Name: 2-tert-butyl-4-(4-chlorophenyl)-5-methyl-3-pyrazolin-3-one Formula: C14H17ClN2O MolecularWeight: 264.75058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C(C)(C)C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1)C(C)(C)C)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H17ClN2O/c1-9-12(10-5-7-11(15)8-6-10)13(18)17(16-9)14(2,3)4/h5-8,16H,1-4H3