1-(2-bromophenyl)-5-propyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(2-bromophenyl)-5-propyl-pyrazole-4-carboxylic acid Openeye Name: 1-(2-bromophenyl)-5-propyl-pyrazole-4-carboxylic acid CAS Name: 1-(2-bromophenyl)-5-propyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(2-bromophenyl)-5-propylpyrazole-4-carboxylic acid Traditional Name: 1-(2-bromophenyl)-5-propyl-pyrazole-4-carboxylic acid Formula: C13H13BrN2O2 MolecularWeight: 309.15852

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=CC=C2Br)C(=O)O

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=CC=C2Br)C(=O)O

InChI

InChI=1S/C13H13BrN2O2/c1-2-5-11-9(13(17)18)8-15-16(11)12-7-4-3-6-10(12)14/h3-4,6-8H,2,5H2,1H3,(H,17,18)