1-[[3,5-bis(iodanyl)-4-methoxy-phenyl]methyl]-5-bromanyl-1,2,3,4-tetrahydroisoquinolin-6-ol

Systemtic Name: 1-[[3,5-bis(iodanyl)-4-methoxy-phenyl]methyl]-5-bromanyl-1,2,3,4-tetrahydroisoquinolin-6-ol Openeye Name: 5-bromo-1-[(3,5-diiodo-4-methoxy-phenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-6-ol CAS Name: 5-bromo-1-[(3,5-diiodo-4-methoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-6-ol IUPAC Name: 5-bromo-1-[(3,5-diiodo-4-methoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-6-ol Traditional Name: 5-bromo-1-(3,5-diiodo-4-methoxy-benzyl)-1,2,3,4-tetrahydroisoquinolin-6-ol Formula: C17H16BrI2NO2 MolecularWeight: 600.02738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1I)CC2C3=C(CCN2)C(=C(C=C3)O)Br)I

Isomeric SMILES

COC1=C(C=C(C=C1I)CC2C3=C(CCN2)C(=C(C=C3)O)Br)I

InChI

InChI=1S/C17H16BrI2NO2/c1-23-17-12(19)6-9(7-13(17)20)8-14-10-2-3-15(22)16(18)11(10)4-5-21-14/h2-3,6-7,14,21-22H,4-5,8H2,1H3