1-(1-methylpyrazol-4-yl)pentane-1,4-dione

Systemtic Name: 1-(1-methylpyrazol-4-yl)pentane-1,4-dione Openeye Name: 1-(1-methylpyrazol-4-yl)pentane-1,4-dione CAS Name: 1-(1-methyl-4-pyrazolyl)pentane-1,4-dione IUPAC Name: 1-(1-methylpyrazol-4-yl)pentane-1,4-dione Traditional Name: 1-(1-methylpyrazol-4-yl)pentane-1,4-dione Formula: C9H12N2O2 MolecularWeight: 180.20378

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)C1=CN(N=C1)C

Isomeric SMILES

CC(=O)CCC(=O)C1=CN(N=C1)C

InChI

InChI=1S/C9H12N2O2/c1-7(12)3-4-9(13)8-5-10-11(2)6-8/h5-6H,3-4H2,1-2H3