1-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)butane-1,3-dione

Systemtic Name: 1-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)butane-1,3-dione Openeye Name: 1-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)butane-1,3-dione CAS Name: 1-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)butane-1,3-dione IUPAC Name: 1-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)butane-1,3-dione Traditional Name: 1-(3-keto-5-methyl-3-pyrazolin-4-yl)butane-1,3-dione Formula: C8H10N2O3 MolecularWeight: 182.1766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)C(=O)CC(=O)C

Isomeric SMILES

CC1=C(C(=O)NN1)C(=O)CC(=O)C

InChI

InChI=1S/C8H10N2O3/c1-4(11)3-6(12)7-5(2)9-10-8(7)13/h3H2,1-2H3,(H2,9,10,13)