5-bromanyl-4-oxidanylidene-3-phenylmethoxy-pyran-2-carboxylic acid

Systemtic Name: 5-bromanyl-4-oxidanylidene-3-phenylmethoxy-pyran-2-carboxylic acid Openeye Name: 3-benzyloxy-5-bromo-4-oxo-pyran-2-carboxylic acid CAS Name: 5-bromo-4-oxo-3-phenylmethoxy-2-pyrancarboxylic acid IUPAC Name: 5-bromo-4-oxo-3-phenylmethoxypyran-2-carboxylic acid Traditional Name: 3-benzoxy-5-bromo-4-keto-pyran-2-carboxylic acid Formula: C13H9BrO5 MolecularWeight: 325.11156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(OC=C(C2=O)Br)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(OC=C(C2=O)Br)C(=O)O

InChI

InChI=1S/C13H9BrO5/c14-9-7-19-12(13(16)17)11(10(9)15)18-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,16,17)