1-(3-bromophenyl)-5-(furan-2-yl)pyrazole-3-carboxylic acid

Systemtic Name: 1-(3-bromophenyl)-5-(furan-2-yl)pyrazole-3-carboxylic acid Openeye Name: 1-(3-bromophenyl)-5-(2-furyl)pyrazole-3-carboxylic acid CAS Name: 1-(3-bromophenyl)-5-(2-furanyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(3-bromophenyl)-5-(furan-2-yl)pyrazole-3-carboxylic acid Traditional Name: 1-(3-bromophenyl)-5-(2-furyl)pyrazole-3-carboxylic acid Formula: C14H9BrN2O3 MolecularWeight: 333.13686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)N2C(=CC(=N2)C(=O)O)C3=CC=CO3

Isomeric SMILES

C1=CC(=CC(=C1)Br)N2C(=CC(=N2)C(=O)O)C3=CC=CO3

InChI

InChI=1S/C14H9BrN2O3/c15-9-3-1-4-10(7-9)17-12(13-5-2-6-20-13)8-11(16-17)14(18)19/h1-8H,(H,18,19)