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

Systemtic Name: [3,5-bis(chloranyl)-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenoxy]methylphosphonic acid Openeye Name: [3,5-dichloro-4-(4-hydroxy-3-isopropyl-phenoxy)phenoxy]methylphosphonic acid CAS Name: [3,5-dichloro-4-(4-hydroxy-3-propan-2-ylphenoxy)phenoxy]methylphosphonic acid IUPAC Name: [3,5-dichloro-4-(4-hydroxy-3-propan-2-ylphenoxy)phenoxy]methylphosphonic acid Traditional Name: [3,5-dichloro-4-(4-hydroxy-3-isopropyl-phenoxy)phenoxy]methylphosphonic acid Formula: C16H17Cl2O6P MolecularWeight: 407.182341

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Cl)OCP(=O)(O)O)Cl)O

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Cl)OCP(=O)(O)O)Cl)O

InChI

InChI=1S/C16H17Cl2O6P/c1-9(2)12-5-10(3-4-15(12)19)24-16-13(17)6-11(7-14(16)18)23-8-25(20,21)22/h3-7,9,19H,8H2,1-2H3,(H2,20,21,22)