2-[[3-(bromomethyl)phenyl]methyl]propanedioic acid

Systemtic Name: 2-[[3-(bromomethyl)phenyl]methyl]propanedioic acid Openeye Name: 2-[[3-(bromomethyl)phenyl]methyl]propanedioic acid CAS Name: 2-[[3-(bromomethyl)phenyl]methyl]propanedioic acid IUPAC Name: 2-[[3-(bromomethyl)phenyl]methyl]propanedioic acid Traditional Name: 2-[3-(bromomethyl)benzyl]malonic acid Formula: C11H11BrO4 MolecularWeight: 287.10664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11BrO4/c12-6-8-3-1-2-7(4-8)5-9(10(13)14)11(15)16/h1-4,9H,5-6H2,(H,13,14)(H,15,16)