3-[3-(3-bromanylpropoxy)phenyl]-2-methoxy-propanoic acid

Systemtic Name: 3-[3-(3-bromanylpropoxy)phenyl]-2-methoxy-propanoic acid Openeye Name: 3-[3-(3-bromopropoxy)phenyl]-2-methoxy-propanoic acid CAS Name: 3-[3-(3-bromopropoxy)phenyl]-2-methoxypropanoic acid IUPAC Name: 3-[3-(3-bromopropoxy)phenyl]-2-methoxypropanoic acid Traditional Name: 3-[3-(3-bromopropoxy)phenyl]-2-methoxy-propionic acid Formula: C13H17BrO4 MolecularWeight: 317.17568

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC1=CC(=CC=C1)OCCCBr)C(=O)O

Isomeric SMILES

COC(CC1=CC(=CC=C1)OCCCBr)C(=O)O

InChI

InChI=1S/C13H17BrO4/c1-17-12(13(15)16)9-10-4-2-5-11(8-10)18-7-3-6-14/h2,4-5,8,12H,3,6-7,9H2,1H3,(H,15,16)