2-azanyl-3-[3-iodanyl-4-(2-iodanyl-4-oxidanyl-phenoxy)-2-propan-2-yl-phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[3-iodanyl-4-(2-iodanyl-4-oxidanyl-phenoxy)-2-propan-2-yl-phenyl]propanoic acid Openeye Name: 2-amino-3-[4-(4-hydroxy-2-iodo-phenoxy)-3-iodo-2-isopropyl-phenyl]propanoic acid CAS Name: 2-amino-3-[4-(4-hydroxy-2-iodophenoxy)-3-iodo-2-propan-2-ylphenyl]propanoic acid IUPAC Name: 2-amino-3-[4-(4-hydroxy-2-iodophenoxy)-3-iodo-2-propan-2-ylphenyl]propanoic acid Traditional Name: 2-amino-3-[4-(4-hydroxy-2-iodo-phenoxy)-3-iodo-2-isopropyl-phenyl]propionic acid Formula: C18H19I2NO4 MolecularWeight: 567.1567

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1I)OC2=C(C=C(C=C2)O)I)CC(C(=O)O)N

Isomeric SMILES

CC(C)C1=C(C=CC(=C1I)OC2=C(C=C(C=C2)O)I)CC(C(=O)O)N

InChI

InChI=1S/C18H19I2NO4/c1-9(2)16-10(7-13(21)18(23)24)3-5-15(17(16)20)25-14-6-4-11(22)8-12(14)19/h3-6,8-9,13,22H,7,21H2,1-2H3,(H,23,24)