1-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-3-phenyl-prop-2-yn-1-one

Systemtic Name: 1-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-3-phenyl-prop-2-yn-1-one Openeye Name: 1-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-3-phenyl-prop-2-yn-1-one CAS Name: 1-(4-chloro-3,5-dimethyl-1-pyrazolyl)-3-phenyl-2-propyn-1-one IUPAC Name: 1-(4-chloro-3,5-dimethylpyrazol-1-yl)-3-phenylprop-2-yn-1-one Traditional Name: 1-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-3-phenyl-prop-2-yn-1-one Formula: C14H11ClN2O MolecularWeight: 258.70294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C#CC2=CC=CC=C2)C)Cl

Isomeric SMILES

CC1=C(C(=NN1C(=O)C#CC2=CC=CC=C2)C)Cl

InChI

InChI=1S/C14H11ClN2O/c1-10-14(15)11(2)17(16-10)13(18)9-8-12-6-4-3-5-7-12/h3-7H,1-2H3