1-(3-bromophenyl)-5-propyl-3-pyridin-3-yl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(3-bromophenyl)-5-propyl-3-pyridin-3-yl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-bromophenyl)-5-propyl-3-(3-pyridyl)pyrazole-4-carboxylic acid CAS Name: 1-(3-bromophenyl)-5-propyl-3-(3-pyridinyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-bromophenyl)-5-propyl-3-pyridin-3-ylpyrazole-4-carboxylic acid Traditional Name: 1-(3-bromophenyl)-5-propyl-3-(3-pyridyl)pyrazole-4-carboxylic acid Formula: C18H16BrN3O2 MolecularWeight: 386.24254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NN1C2=CC(=CC=C2)Br)C3=CN=CC=C3)C(=O)O

Isomeric SMILES

CCCC1=C(C(=NN1C2=CC(=CC=C2)Br)C3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C18H16BrN3O2/c1-2-5-15-16(18(23)24)17(12-6-4-9-20-11-12)21-22(15)14-8-3-7-13(19)10-14/h3-4,6-11H,2,5H2,1H3,(H,23,24)