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

Systemtic Name: 2-[3,5-bis(iodanyl)-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]ethylphosphonic acid Openeye Name: 2-[4-(4-hydroxy-3-isopropyl-phenoxy)-3,5-diiodo-phenyl]ethylphosphonic acid CAS Name: 2-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-diiodophenyl]ethylphosphonic acid IUPAC Name: 2-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-diiodophenyl]ethylphosphonic acid Traditional Name: 2-[4-(4-hydroxy-3-isopropyl-phenoxy)-3,5-diiodo-phenyl]ethylphosphonic acid Formula: C17H19I2O5P MolecularWeight: 588.112461

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19I2O5P/c1-10(2)13-9-12(3-4-16(13)20)24-17-14(18)7-11(8-15(17)19)5-6-25(21,22)23/h3-4,7-10,20H,5-6H2,1-2H3,(H2,21,22,23)