2-(3-tert-butyl-5-chloranyl-4-oxidanyl-phenyl)propylphosphonic acid

Systemtic Name: 2-(3-tert-butyl-5-chloranyl-4-oxidanyl-phenyl)propylphosphonic acid Openeye Name: 2-(3-tert-butyl-5-chloro-4-hydroxy-phenyl)propylphosphonic acid CAS Name: 2-(3-tert-butyl-5-chloro-4-hydroxyphenyl)propylphosphonic acid IUPAC Name: 2-(3-tert-butyl-5-chloro-4-hydroxyphenyl)propylphosphonic acid Traditional Name: 2-(3-tert-butyl-5-chloro-4-hydroxy-phenyl)propylphosphonic acid Formula: C13H20ClO4P MolecularWeight: 306.722261

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Descriptors Computed from Structure

Canonical SMILES:

CC(CP(=O)(O)O)C1=CC(=C(C(=C1)Cl)O)C(C)(C)C

Isomeric SMILES

CC(CP(=O)(O)O)C1=CC(=C(C(=C1)Cl)O)C(C)(C)C

InChI

InChI=1S/C13H20ClO4P/c1-8(7-19(16,17)18)9-5-10(13(2,3)4)12(15)11(14)6-9/h5-6,8,15H,7H2,1-4H3,(H2,16,17,18)