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

Systemtic Name: 1-(2-bromophenyl)-5-cyclopropyl-pyrazole-4-carboxylic acid Openeye Name: 1-(2-bromophenyl)-5-cyclopropyl-pyrazole-4-carboxylic acid CAS Name: 1-(2-bromophenyl)-5-cyclopropyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(2-bromophenyl)-5-cyclopropylpyrazole-4-carboxylic acid Traditional Name: 1-(2-bromophenyl)-5-cyclopropyl-pyrazole-4-carboxylic acid Formula: C13H11BrN2O2 MolecularWeight: 307.14264

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C=NN2C3=CC=CC=C3Br)C(=O)O

Isomeric SMILES

C1CC1C2=C(C=NN2C3=CC=CC=C3Br)C(=O)O

InChI

InChI=1S/C13H11BrN2O2/c14-10-3-1-2-4-11(10)16-12(8-5-6-8)9(7-15-16)13(17)18/h1-4,7-8H,5-6H2,(H,17,18)