(3-chloranyl-4-oxidanyl-5-propan-2-yl-phenyl)methylphosphonic acid

Systemtic Name: (3-chloranyl-4-oxidanyl-5-propan-2-yl-phenyl)methylphosphonic acid Openeye Name: (3-chloro-4-hydroxy-5-isopropyl-phenyl)methylphosphonic acid CAS Name: (3-chloro-4-hydroxy-5-propan-2-ylphenyl)methylphosphonic acid IUPAC Name: (3-chloro-4-hydroxy-5-propan-2-ylphenyl)methylphosphonic acid Traditional Name: (3-chloro-4-hydroxy-5-isopropyl-benzyl)phosphonic acid Formula: C10H14ClO4P MolecularWeight: 264.642521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14ClO4P/c1-6(2)8-3-7(5-16(13,14)15)4-9(11)10(8)12/h3-4,6,12H,5H2,1-2H3,(H2,13,14,15)