4-tert-butyl-5-methyl-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 4-tert-butyl-5-methyl-2-phenyl-1H-pyrazol-3-one Openeye Name: 4-tert-butyl-5-methyl-2-phenyl-1H-pyrazol-3-one CAS Name: 4-tert-butyl-5-methyl-2-phenyl-1H-pyrazol-3-one IUPAC Name: 4-tert-butyl-5-methyl-2-phenyl-1H-pyrazol-3-one Traditional Name: 4-tert-butyl-5-methyl-2-phenyl-3-pyrazolin-3-one Formula: C14H18N2O MolecularWeight: 230.30552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O/c1-10-12(14(2,3)4)13(17)16(15-10)11-8-6-5-7-9-11/h5-9,15H,1-4H3