5-(5-bromanyl-2-ethoxy-phenyl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(5-bromanyl-2-ethoxy-phenyl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-(5-bromo-2-ethoxy-phenyl)-5-oxo-pentanoic acid CAS Name: 5-(5-bromo-2-ethoxyphenyl)-5-oxopentanoic acid IUPAC Name: 5-(5-bromo-2-ethoxyphenyl)-5-oxopentanoic acid Traditional Name: 5-(5-bromo-2-ethoxy-phenyl)-5-keto-valeric acid Formula: C13H15BrO4 MolecularWeight: 315.1598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C(=O)CCCC(=O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C(=O)CCCC(=O)O

InChI

InChI=1S/C13H15BrO4/c1-2-18-12-7-6-9(14)8-10(12)11(15)4-3-5-13(16)17/h6-8H,2-5H2,1H3,(H,16,17)