6-[2-[5-bromanyl-2-(oxolan-3-ylmethoxy)phenyl]phenyl]pyridine-2-carboxylic acid

Systemtic Name: 6-[2-[5-bromanyl-2-(oxolan-3-ylmethoxy)phenyl]phenyl]pyridine-2-carboxylic acid Openeye Name: 6-[2-[5-bromo-2-(tetrahydrofuran-3-ylmethoxy)phenyl]phenyl]pyridine-2-carboxylic acid CAS Name: 6-[2-[5-bromo-2-(3-oxolanylmethoxy)phenyl]phenyl]-2-pyridinecarboxylic acid IUPAC Name: 6-[2-[5-bromo-2-(oxolan-3-ylmethoxy)phenyl]phenyl]pyridine-2-carboxylic acid Traditional Name: 6-[2-[5-bromo-2-(tetrahydrofuran-3-ylmethoxy)phenyl]phenyl]picolinic acid Formula: C23H20BrNO4 MolecularWeight: 454.3132

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1COC2=C(C=C(C=C2)Br)C3=CC=CC=C3C4=NC(=CC=C4)C(=O)O

Isomeric SMILES

C1COCC1COC2=C(C=C(C=C2)Br)C3=CC=CC=C3C4=NC(=CC=C4)C(=O)O

InChI

InChI=1S/C23H20BrNO4/c24-16-8-9-22(29-14-15-10-11-28-13-15)19(12-16)17-4-1-2-5-18(17)20-6-3-7-21(25-20)23(26)27/h1-9,12,15H,10-11,13-14H2,(H,26,27)