(1R)-1-[[3,5-bis(iodanyl)-4-methoxy-phenyl]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol

Systemtic Name: (1R)-1-[[3,5-bis(iodanyl)-4-methoxy-phenyl]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Openeye Name: (1R)-1-[(3,5-diiodo-4-methoxy-phenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol CAS Name: (1R)-1-[(3,5-diiodo-4-methoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol IUPAC Name: (1R)-1-[(3,5-diiodo-4-methoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Traditional Name: (1R)-1-(3,5-diiodo-4-methoxy-benzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol Formula: C17H17I2NO3 MolecularWeight: 537.13072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1I)CC2C3=CC(=C(C=C3CCN2)O)O)I

Isomeric SMILES

COC1=C(C=C(C=C1I)C[C@@H]2C3=CC(=C(C=C3CCN2)O)O)I

InChI

InChI=1S/C17H17I2NO3/c1-23-17-12(18)4-9(5-13(17)19)6-14-11-8-16(22)15(21)7-10(11)2-3-20-14/h4-5,7-8,14,20-22H,2-3,6H2,1H3/t14-/m1/s1