2-(3-iodanylphenoxy)quinoline-4-carboxylic acid

Systemtic Name: 2-(3-iodanylphenoxy)quinoline-4-carboxylic acid Openeye Name: 2-(3-iodophenoxy)quinoline-4-carboxylic acid CAS Name: 2-(3-iodophenoxy)-4-quinolinecarboxylic acid IUPAC Name: 2-(3-iodophenoxy)quinoline-4-carboxylic acid Traditional Name: 2-(3-iodophenoxy)cinchoninic acid Formula: C16H10INO3 MolecularWeight: 391.15997

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)OC3=CC(=CC=C3)I)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)OC3=CC(=CC=C3)I)C(=O)O

InChI

InChI=1S/C16H10INO3/c17-10-4-3-5-11(8-10)21-15-9-13(16(19)20)12-6-1-2-7-14(12)18-15/h1-9H,(H,19,20)