4-(4-ethyl-2,3-dimethyl-phenyl)carbonyl-2,5-dimethyl-1H-pyrazol-3-one

Systemtic Name: 4-(4-ethyl-2,3-dimethyl-phenyl)carbonyl-2,5-dimethyl-1H-pyrazol-3-one Openeye Name: 4-(4-ethyl-2,3-dimethyl-benzoyl)-2,5-dimethyl-1H-pyrazol-3-one CAS Name: 4-[(4-ethyl-2,3-dimethylphenyl)-oxomethyl]-2,5-dimethyl-1H-pyrazol-3-one IUPAC Name: 4-(4-ethyl-2,3-dimethylbenzoyl)-2,5-dimethyl-1H-pyrazol-3-one Traditional Name: 4-(4-ethyl-2,3-dimethyl-benzoyl)-2,5-dimethyl-3-pyrazolin-3-one Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)C(=O)C2=C(NN(C2=O)C)C)C)C

Isomeric SMILES

CCC1=C(C(=C(C=C1)C(=O)C2=C(NN(C2=O)C)C)C)C

InChI

InChI=1S/C16H20N2O2/c1-6-12-7-8-13(10(3)9(12)2)15(19)14-11(4)17-18(5)16(14)20/h7-8,17H,6H2,1-5H3