(2S)-3-(3-bromanyl-4-oxidanyl-phenyl)-2-oxidanyl-propanoic acid

Systemtic Name: (2S)-3-(3-bromanyl-4-oxidanyl-phenyl)-2-oxidanyl-propanoic acid Openeye Name: (2S)-3-(3-bromo-4-hydroxy-phenyl)-2-hydroxy-propanoic acid CAS Name: (2S)-3-(3-bromo-4-hydroxyphenyl)-2-hydroxypropanoic acid IUPAC Name: (2S)-3-(3-bromo-4-hydroxyphenyl)-2-hydroxypropanoic acid Traditional Name: (2S)-3-(3-bromo-4-hydroxy-phenyl)-2-hydroxy-propionic acid Formula: C9H9BrO4 MolecularWeight: 261.06936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC(C(=O)O)O)Br)O

Isomeric SMILES

C1=CC(=C(C=C1C[C@@H](C(=O)O)O)Br)O

InChI

InChI=1S/C9H9BrO4/c10-6-3-5(1-2-7(6)11)4-8(12)9(13)14/h1-3,8,11-12H,4H2,(H,13,14)/t8-/m0/s1