6-[2-[5-bromanyl-2-(oxan-4-ylmethoxy)phenyl]phenyl]pyridine-2-carboxylic acid

Systemtic Name: 6-[2-[5-bromanyl-2-(oxan-4-ylmethoxy)phenyl]phenyl]pyridine-2-carboxylic acid Openeye Name: 6-[2-[5-bromo-2-(tetrahydropyran-4-ylmethoxy)phenyl]phenyl]pyridine-2-carboxylic acid CAS Name: 6-[2-[5-bromo-2-(4-oxanylmethoxy)phenyl]phenyl]-2-pyridinecarboxylic acid IUPAC Name: 6-[2-[5-bromo-2-(oxan-4-ylmethoxy)phenyl]phenyl]pyridine-2-carboxylic acid Traditional Name: 6-[2-[5-bromo-2-(tetrahydropyran-4-ylmethoxy)phenyl]phenyl]picolinic acid Formula: C24H22BrNO4 MolecularWeight: 468.33978

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1COC2=C(C=C(C=C2)Br)C3=CC=CC=C3C4=NC(=CC=C4)C(=O)O

Isomeric SMILES

C1COCCC1COC2=C(C=C(C=C2)Br)C3=CC=CC=C3C4=NC(=CC=C4)C(=O)O

InChI

InChI=1S/C24H22BrNO4/c25-17-8-9-23(30-15-16-10-12-29-13-11-16)20(14-17)18-4-1-2-5-19(18)21-6-3-7-22(26-21)24(27)28/h1-9,14,16H,10-13,15H2,(H,27,28)