3-(2-bromanyl-1,1-dimethoxy-ethyl)benzoic acid

Systemtic Name: 3-(2-bromanyl-1,1-dimethoxy-ethyl)benzoic acid Openeye Name: 3-(2-bromo-1,1-dimethoxy-ethyl)benzoic acid CAS Name: 3-(2-bromo-1,1-dimethoxyethyl)benzoic acid IUPAC Name: 3-(2-bromo-1,1-dimethoxyethyl)benzoic acid Traditional Name: 3-(2-bromo-1,1-dimethoxy-ethyl)benzoic acid Formula: C11H13BrO4 MolecularWeight: 289.12252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13BrO4/c1-15-11(7-12,16-2)9-5-3-4-8(6-9)10(13)14/h3-6H,7H2,1-2H3,(H,13,14)