(E)-1-(3,5-dimethylpyrazol-1-yl)but-2-en-1-one

Systemtic Name: (E)-1-(3,5-dimethylpyrazol-1-yl)but-2-en-1-one Openeye Name: (E)-1-(3,5-dimethylpyrazol-1-yl)but-2-en-1-one CAS Name: (E)-1-(3,5-dimethyl-1-pyrazolyl)-2-buten-1-one IUPAC Name: (E)-1-(3,5-dimethylpyrazol-1-yl)but-2-en-1-one Traditional Name: (E)-1-(3,5-dimethylpyrazol-1-yl)but-2-en-1-one Formula: C9H12N2O MolecularWeight: 164.20438

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1C(=CC(=N1)C)C

Isomeric SMILES

C/C=C/C(=O)N1C(=CC(=N1)C)C

InChI

InChI=1S/C9H12N2O/c1-4-5-9(12)11-8(3)6-7(2)10-11/h4-6H,1-3H3/b5-4+