4-(4-tert-butylphenyl)carbonyl-2,5-dimethyl-1H-pyrazol-3-one

Systemtic Name: 4-(4-tert-butylphenyl)carbonyl-2,5-dimethyl-1H-pyrazol-3-one Openeye Name: 4-(4-tert-butylbenzoyl)-2,5-dimethyl-1H-pyrazol-3-one CAS Name: 4-[(4-tert-butylphenyl)-oxomethyl]-2,5-dimethyl-1H-pyrazol-3-one IUPAC Name: 4-(4-tert-butylbenzoyl)-2,5-dimethyl-1H-pyrazol-3-one Traditional Name: 4-(4-tert-butylbenzoyl)-2,5-dimethyl-3-pyrazolin-3-one Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O2/c1-10-13(15(20)18(5)17-10)14(19)11-6-8-12(9-7-11)16(2,3)4/h6-9,17H,1-5H3