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

Systemtic Name: 5-(2-methylpropyl)-1-phenyl-pyrazole-3-carboxylate Openeye Name: 5-isobutyl-1-phenyl-pyrazole-3-carboxylate CAS Name: 5-(2-methylpropyl)-1-phenyl-3-pyrazolecarboxylate IUPAC Name: 5-(2-methylpropyl)-1-phenylpyrazole-3-carboxylate Traditional Name: 5-isobutyl-1-phenyl-pyrazole-3-carboxylate Formula: C14H15N2O2- MolecularWeight: 243.2811

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=NN1C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC(C)CC1=CC(=NN1C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C14H16N2O2/c1-10(2)8-12-9-13(14(17)18)15-16(12)11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,17,18)/p-1