2-[2-(2-methylpropyl)-3-oxidanylidene-1H-pyrazol-5-yl]ethanoate

Systemtic Name: 2-[2-(2-methylpropyl)-3-oxidanylidene-1H-pyrazol-5-yl]ethanoate Openeye Name: 2-(2-isobutyl-3-oxo-1H-pyrazol-5-yl)acetate CAS Name: 2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetate IUPAC Name: 2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetate Traditional Name: 2-(1-isobutyl-5-keto-3-pyrazolin-3-yl)acetate Formula: C9H13N2O3- MolecularWeight: 197.21112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C=C(N1)CC(=O)[O-]

Isomeric SMILES

CC(C)CN1C(=O)C=C(N1)CC(=O)[O-]

InChI

InChI=1S/C9H14N2O3/c1-6(2)5-11-8(12)3-7(10-11)4-9(13)14/h3,6,10H,4-5H2,1-2H3,(H,13,14)/p-1