5-[[(3-iodanylphenyl)methyl-[(8-oxidanylquinolin-5-yl)methyl]amino]methyl]quinolin-8-ol

Systemtic Name: 5-[[(3-iodanylphenyl)methyl-[(8-oxidanylquinolin-5-yl)methyl]amino]methyl]quinolin-8-ol Openeye Name: 5-[[(8-hydroxy-5-quinolyl)methyl-[(3-iodophenyl)methyl]amino]methyl]quinolin-8-ol CAS Name: 5-[[(8-hydroxy-5-quinolinyl)methyl-[(3-iodophenyl)methyl]amino]methyl]-8-quinolinol IUPAC Name: 5-[[(8-hydroxyquinolin-5-yl)methyl-[(3-iodophenyl)methyl]amino]methyl]quinolin-8-ol Traditional Name: 5-[[(8-hydroxy-5-quinolyl)methyl-(3-iodobenzyl)amino]methyl]quinolin-8-ol Formula: C27H22IN3O2 MolecularWeight: 547.38695

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)CN(CC2=C3C=CC=NC3=C(C=C2)O)CC4=C5C=CC=NC5=C(C=C4)O

Isomeric SMILES

C1=CC(=CC(=C1)I)CN(CC2=C3C=CC=NC3=C(C=C2)O)CC4=C5C=CC=NC5=C(C=C4)O

InChI

InChI=1S/C27H22IN3O2/c28-21-5-1-4-18(14-21)15-31(16-19-8-10-24(32)26-22(19)6-2-12-29-26)17-20-9-11-25(33)27-23(20)7-3-13-30-27/h1-14,32-33H,15-17H2