6-[2-[5-bromanyl-2-(2-methylpropoxy)phenyl]phenyl]pyridine-2-carboxylic acid

Systemtic Name: 6-[2-[5-bromanyl-2-(2-methylpropoxy)phenyl]phenyl]pyridine-2-carboxylic acid Openeye Name: 6-[2-(5-bromo-2-isobutoxy-phenyl)phenyl]pyridine-2-carboxylic acid CAS Name: 6-[2-[5-bromo-2-(2-methylpropoxy)phenyl]phenyl]-2-pyridinecarboxylic acid IUPAC Name: 6-[2-[5-bromo-2-(2-methylpropoxy)phenyl]phenyl]pyridine-2-carboxylic acid Traditional Name: 6-[2-(5-bromo-2-isobutoxy-phenyl)phenyl]picolinic acid Formula: C22H20BrNO3 MolecularWeight: 426.3031

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)Br)C2=CC=CC=C2C3=NC(=CC=C3)C(=O)O

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)Br)C2=CC=CC=C2C3=NC(=CC=C3)C(=O)O

InChI

InChI=1S/C22H20BrNO3/c1-14(2)13-27-21-11-10-15(23)12-18(21)16-6-3-4-7-17(16)19-8-5-9-20(24-19)22(25)26/h3-12,14H,13H2,1-2H3,(H,25,26)