1-(4-bromophenyl)-5-propan-2-yl-pyrazole-3-carboxylate

Systemtic Name: 1-(4-bromophenyl)-5-propan-2-yl-pyrazole-3-carboxylate Openeye Name: 1-(4-bromophenyl)-5-isopropyl-pyrazole-3-carboxylate CAS Name: 1-(4-bromophenyl)-5-propan-2-yl-3-pyrazolecarboxylate IUPAC Name: 1-(4-bromophenyl)-5-propan-2-ylpyrazole-3-carboxylate Traditional Name: 1-(4-bromophenyl)-5-isopropyl-pyrazole-3-carboxylate Formula: C13H12BrN2O2- MolecularWeight: 308.15058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NN1C2=CC=C(C=C2)Br)C(=O)[O-]

Isomeric SMILES

CC(C)C1=CC(=NN1C2=CC=C(C=C2)Br)C(=O)[O-]

InChI

InChI=1S/C13H13BrN2O2/c1-8(2)12-7-11(13(17)18)15-16(12)10-5-3-9(14)4-6-10/h3-8H,1-2H3,(H,17,18)/p-1