1-(3,5-dimethylpyrazol-1-yl)prop-2-yn-1-one

Systemtic Name: 1-(3,5-dimethylpyrazol-1-yl)prop-2-yn-1-one Openeye Name: 1-(3,5-dimethylpyrazol-1-yl)prop-2-yn-1-one CAS Name: 1-(3,5-dimethyl-1-pyrazolyl)-2-propyn-1-one IUPAC Name: 1-(3,5-dimethylpyrazol-1-yl)prop-2-yn-1-one Traditional Name: 1-(3,5-dimethylpyrazol-1-yl)prop-2-yn-1-one Formula: C8H8N2O MolecularWeight: 148.16192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)C#C)C

Isomeric SMILES

CC1=CC(=NN1C(=O)C#C)C

InChI

InChI=1S/C8H8N2O/c1-4-8(11)10-7(3)5-6(2)9-10/h1,5H,2-3H3