(3-bromanyl-5-ethyl-4-oxidanyl-phenyl)methylphosphonic acid

Systemtic Name: (3-bromanyl-5-ethyl-4-oxidanyl-phenyl)methylphosphonic acid Openeye Name: (3-bromo-5-ethyl-4-hydroxy-phenyl)methylphosphonic acid CAS Name: (3-bromo-5-ethyl-4-hydroxyphenyl)methylphosphonic acid IUPAC Name: (3-bromo-5-ethyl-4-hydroxyphenyl)methylphosphonic acid Traditional Name: (3-bromo-5-ethyl-4-hydroxy-benzyl)phosphonic acid Formula: C9H12BrO4P MolecularWeight: 295.066941

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)CP(=O)(O)O)Br)O

Isomeric SMILES

CCC1=C(C(=CC(=C1)CP(=O)(O)O)Br)O

InChI

InChI=1S/C9H12BrO4P/c1-2-7-3-6(5-15(12,13)14)4-8(10)9(7)11/h3-4,11H,2,5H2,1H3,(H2,12,13,14)