2-(3-bromanylpropoxy)-1-(3,5-dimethoxyphenyl)ethanone

Systemtic Name: 2-(3-bromanylpropoxy)-1-(3,5-dimethoxyphenyl)ethanone Openeye Name: 2-(3-bromopropoxy)-1-(3,5-dimethoxyphenyl)ethanone CAS Name: 2-(3-bromopropoxy)-1-(3,5-dimethoxyphenyl)ethanone IUPAC Name: 2-(3-bromopropoxy)-1-(3,5-dimethoxyphenyl)ethanone Traditional Name: 2-(3-bromopropoxy)-1-(3,5-dimethoxyphenyl)ethanone Formula: C13H17BrO4 MolecularWeight: 317.17568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)COCCCBr)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)COCCCBr)OC

InChI

InChI=1S/C13H17BrO4/c1-16-11-6-10(7-12(8-11)17-2)13(15)9-18-5-3-4-14/h6-8H,3-5,9H2,1-2H3