1-[4-(2-bromoethyloxy)-3-oxidanyl-2-propyl-phenyl]ethanone

Systemtic Name: 1-[4-(2-bromoethyloxy)-3-oxidanyl-2-propyl-phenyl]ethanone Openeye Name: 1-[4-(2-bromoethoxy)-3-hydroxy-2-propyl-phenyl]ethanone CAS Name: 1-[4-(2-bromoethoxy)-3-hydroxy-2-propylphenyl]ethanone IUPAC Name: 1-[4-(2-bromoethoxy)-3-hydroxy-2-propylphenyl]ethanone Traditional Name: 1-[4-(2-bromoethoxy)-3-hydroxy-2-propyl-phenyl]ethanone Formula: C13H17BrO3 MolecularWeight: 301.17628

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)OCCBr)C(=O)C

Isomeric SMILES

CCCC1=C(C=CC(=C1O)OCCBr)C(=O)C

InChI

InChI=1S/C13H17BrO3/c1-3-4-11-10(9(2)15)5-6-12(13(11)16)17-8-7-14/h5-6,16H,3-4,7-8H2,1-2H3