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

Systemtic Name: [3,5-bis(bromanyl)-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]methylphosphonic acid Openeye Name: [3,5-dibromo-4-(4-hydroxy-3-isopropyl-phenoxy)phenyl]methylphosphonic acid CAS Name: [3,5-dibromo-4-(4-hydroxy-3-propan-2-ylphenoxy)phenyl]methylphosphonic acid IUPAC Name: [3,5-dibromo-4-(4-hydroxy-3-propan-2-ylphenoxy)phenyl]methylphosphonic acid Traditional Name: [3,5-dibromo-4-(4-hydroxy-3-isopropyl-phenoxy)benzyl]phosphonic acid Formula: C16H17Br2O5P MolecularWeight: 480.084941

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Br)CP(=O)(O)O)Br)O

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Br)CP(=O)(O)O)Br)O

InChI

InChI=1S/C16H17Br2O5P/c1-9(2)12-7-11(3-4-15(12)19)23-16-13(17)5-10(6-14(16)18)8-24(20,21)22/h3-7,9,19H,8H2,1-2H3,(H2,20,21,22)