2-[3-(bromomethyl)-4-oxidanyl-phenyl]propanedioic acid

Systemtic Name: 2-[3-(bromomethyl)-4-oxidanyl-phenyl]propanedioic acid Openeye Name: 2-[3-(bromomethyl)-4-hydroxy-phenyl]propanedioic acid CAS Name: 2-[3-(bromomethyl)-4-hydroxyphenyl]propanedioic acid IUPAC Name: 2-[3-(bromomethyl)-4-hydroxyphenyl]propanedioic acid Traditional Name: 2-[3-(bromomethyl)-4-hydroxy-phenyl]malonic acid Formula: C10H9BrO5 MolecularWeight: 289.07946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(C(=O)O)C(=O)O)CBr)O

Isomeric SMILES

C1=CC(=C(C=C1C(C(=O)O)C(=O)O)CBr)O

InChI

InChI=1S/C10H9BrO5/c11-4-6-3-5(1-2-7(6)12)8(9(13)14)10(15)16/h1-3,8,12H,4H2,(H,13,14)(H,15,16)