6-[2-[5-bromanyl-2-(3-phenylprop-2-ynoxy)phenyl]phenyl]pyridine-2-carboxylic acid

Systemtic Name: 6-[2-[5-bromanyl-2-(3-phenylprop-2-ynoxy)phenyl]phenyl]pyridine-2-carboxylic acid Openeye Name: 6-[2-[5-bromo-2-(3-phenylprop-2-ynoxy)phenyl]phenyl]pyridine-2-carboxylic acid CAS Name: 6-[2-[5-bromo-2-(3-phenylprop-2-ynoxy)phenyl]phenyl]-2-pyridinecarboxylic acid IUPAC Name: 6-[2-[5-bromo-2-(3-phenylprop-2-ynoxy)phenyl]phenyl]pyridine-2-carboxylic acid Traditional Name: 6-[2-[5-bromo-2-(3-phenylprop-2-ynoxy)phenyl]phenyl]picolinic acid Formula: C27H18BrNO3 MolecularWeight: 484.34072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CCOC2=C(C=C(C=C2)Br)C3=CC=CC=C3C4=NC(=CC=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C#CCOC2=C(C=C(C=C2)Br)C3=CC=CC=C3C4=NC(=CC=C4)C(=O)O

InChI

InChI=1S/C27H18BrNO3/c28-20-15-16-26(32-17-7-10-19-8-2-1-3-9-19)23(18-20)21-11-4-5-12-22(21)24-13-6-14-25(29-24)27(30)31/h1-6,8-9,11-16,18H,17H2,(H,30,31)