5-ethyl-3-(2-methylpropyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: 5-ethyl-3-(2-methylpropyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: 5-ethyl-3-isobutyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-ethyl-3-(2-methylpropyl)-1-phenyl-4-pyrazolecarboxylate IUPAC Name: 5-ethyl-3-(2-methylpropyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 5-ethyl-3-isobutyl-1-phenyl-pyrazole-4-carboxylate Formula: C16H19N2O2- MolecularWeight: 271.33426

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC=CC=C2)CC(C)C)C(=O)[O-]

Isomeric SMILES

CCC1=C(C(=NN1C2=CC=CC=C2)CC(C)C)C(=O)[O-]

InChI

InChI=1S/C16H20N2O2/c1-4-14-15(16(19)20)13(10-11(2)3)17-18(14)12-8-6-5-7-9-12/h5-9,11H,4,10H2,1-3H3,(H,19,20)/p-1