1-(1,5-dimethylpyrazol-4-yl)butane-1,3-dione

Systemtic Name: 1-(1,5-dimethylpyrazol-4-yl)butane-1,3-dione Openeye Name: 1-(1,5-dimethylpyrazol-4-yl)butane-1,3-dione CAS Name: 1-(1,5-dimethyl-4-pyrazolyl)butane-1,3-dione IUPAC Name: 1-(1,5-dimethylpyrazol-4-yl)butane-1,3-dione Traditional Name: 1-(1,5-dimethylpyrazol-4-yl)butane-1,3-dione Formula: C9H12N2O2 MolecularWeight: 180.20378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12N2O2/c1-6(12)4-9(13)8-5-10-11(3)7(8)2/h5H,4H2,1-3H3