5-(2,2-dimethylpropyl)-2-methyl-4-pyridin-3-ylcarbonyl-1H-pyrazol-3-one

Systemtic Name: 5-(2,2-dimethylpropyl)-2-methyl-4-pyridin-3-ylcarbonyl-1H-pyrazol-3-one Openeye Name: 5-(2,2-dimethylpropyl)-2-methyl-4-(pyridine-3-carbonyl)-1H-pyrazol-3-one CAS Name: 5-(2,2-dimethylpropyl)-2-methyl-4-[oxo(3-pyridinyl)methyl]-1H-pyrazol-3-one IUPAC Name: 5-(2,2-dimethylpropyl)-2-methyl-4-(pyridine-3-carbonyl)-1H-pyrazol-3-one Traditional Name: 2-methyl-5-neopentyl-4-nicotinoyl-3-pyrazolin-3-one Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O2/c1-15(2,3)8-11-12(14(20)18(4)17-11)13(19)10-6-5-7-16-9-10/h5-7,9,17H,8H2,1-4H3