6-(5-bromanyl-2-ethoxy-phenyl)-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(5-bromanyl-2-ethoxy-phenyl)-6-oxidanylidene-hexanoic acid Openeye Name: 6-(5-bromo-2-ethoxy-phenyl)-6-oxo-hexanoic acid CAS Name: 6-(5-bromo-2-ethoxyphenyl)-6-oxohexanoic acid IUPAC Name: 6-(5-bromo-2-ethoxyphenyl)-6-oxohexanoic acid Traditional Name: 6-(5-bromo-2-ethoxy-phenyl)-6-keto-hexanoic acid Formula: C14H17BrO4 MolecularWeight: 329.18638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17BrO4/c1-2-19-13-8-7-10(15)9-11(13)12(16)5-3-4-6-14(17)18/h7-9H,2-6H2,1H3,(H,17,18)