2-[[3,5-bis(iodanyl)-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]amino]ethanoic acid

Systemtic Name: 2-[[3,5-bis(iodanyl)-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]amino]ethanoic acid Openeye Name: 2-[4-(4-hydroxy-3-isopropyl-phenoxy)-3,5-diiodo-anilino]acetic acid CAS Name: 2-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-diiodoanilino]acetic acid IUPAC Name: 2-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-diiodoanilino]acetic acid Traditional Name: 2-[4-(4-hydroxy-3-isopropyl-phenoxy)-3,5-diiodo-anilino]acetic acid Formula: C17H17I2NO4 MolecularWeight: 553.13012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2I)NCC(=O)O)I)O

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2I)NCC(=O)O)I)O

InChI

InChI=1S/C17H17I2NO4/c1-9(2)12-7-11(3-4-15(12)21)24-17-13(18)5-10(6-14(17)19)20-8-16(22)23/h3-7,9,20-21H,8H2,1-2H3,(H,22,23)