[3,5-dimethyl-4-(3-oxidanylprop-1-ynyl)pyrazol-1-yl]-(2,4,6-trimethylphenyl)methanone

Systemtic Name: [3,5-dimethyl-4-(3-oxidanylprop-1-ynyl)pyrazol-1-yl]-(2,4,6-trimethylphenyl)methanone Openeye Name: [4-(3-hydroxyprop-1-ynyl)-3,5-dimethyl-pyrazol-1-yl]-(2,4,6-trimethylphenyl)methanone CAS Name: [4-(3-hydroxyprop-1-ynyl)-3,5-dimethyl-1-pyrazolyl]-(2,4,6-trimethylphenyl)methanone IUPAC Name: [4-(3-hydroxyprop-1-ynyl)-3,5-dimethylpyrazol-1-yl]-(2,4,6-trimethylphenyl)methanone Traditional Name: [4-(3-hydroxyprop-1-ynyl)-3,5-dimethyl-pyrazol-1-yl]-mesityl-methanone Formula: C18H20N2O2 MolecularWeight: 296.3636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)N2C(=C(C(=N2)C)C#CCO)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)N2C(=C(C(=N2)C)C#CCO)C)C

InChI

InChI=1S/C18H20N2O2/c1-11-9-12(2)17(13(3)10-11)18(22)20-15(5)16(7-6-8-21)14(4)19-20/h9-10,21H,8H2,1-5H3