3-[2-(5-bromanylpentoxy)-5-chloranyl-phenyl]propanoic acid

Systemtic Name: 3-[2-(5-bromanylpentoxy)-5-chloranyl-phenyl]propanoic acid Openeye Name: 3-[2-(5-bromopentoxy)-5-chloro-phenyl]propanoic acid CAS Name: 3-[2-(5-bromopentoxy)-5-chlorophenyl]propanoic acid IUPAC Name: 3-[2-(5-bromopentoxy)-5-chlorophenyl]propanoic acid Traditional Name: 3-[2-(5-bromopentoxy)-5-chloro-phenyl]propionic acid Formula: C14H18BrClO3 MolecularWeight: 349.64792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)CCC(=O)O)OCCCCCBr

Isomeric SMILES

C1=CC(=C(C=C1Cl)CCC(=O)O)OCCCCCBr

InChI

InChI=1S/C14H18BrClO3/c15-8-2-1-3-9-19-13-6-5-12(16)10-11(13)4-7-14(17)18/h5-6,10H,1-4,7-9H2,(H,17,18)