1-methyl-5-(2-methylpropyl)pyrazole-3-carboxylate

Systemtic Name: 1-methyl-5-(2-methylpropyl)pyrazole-3-carboxylate Openeye Name: 5-isobutyl-1-methyl-pyrazole-3-carboxylate CAS Name: 1-methyl-5-(2-methylpropyl)-3-pyrazolecarboxylate IUPAC Name: 1-methyl-5-(2-methylpropyl)pyrazole-3-carboxylate Traditional Name: 5-isobutyl-1-methyl-pyrazole-3-carboxylate Formula: C9H13N2O2- MolecularWeight: 181.21172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=NN1C)C(=O)[O-]

Isomeric SMILES

CC(C)CC1=CC(=NN1C)C(=O)[O-]

InChI

InChI=1S/C9H14N2O2/c1-6(2)4-7-5-8(9(12)13)10-11(7)3/h5-6H,4H2,1-3H3,(H,12,13)/p-1