3-bromanyl-4-oxidanylidene-4-(2-phenylmethoxyethoxy)butanoic acid

Systemtic Name: 3-bromanyl-4-oxidanylidene-4-(2-phenylmethoxyethoxy)butanoic acid Openeye Name: 4-(2-benzyloxyethoxy)-3-bromo-4-oxo-butanoic acid CAS Name: 3-bromo-4-oxo-4-(2-phenylmethoxyethoxy)butanoic acid IUPAC Name: 3-bromo-4-oxo-4-(2-phenylmethoxyethoxy)butanoic acid Traditional Name: 4-(2-benzoxyethoxy)-3-bromo-4-keto-butyric acid Formula: C13H15BrO5 MolecularWeight: 331.1592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrO5/c14-11(8-12(15)16)13(17)19-7-6-18-9-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,15,16)