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

Systemtic Name: 1-[4-(3-bromanylpropoxy)-3-oxidanyl-2-propyl-phenyl]ethanone Openeye Name: 1-[4-(3-bromopropoxy)-3-hydroxy-2-propyl-phenyl]ethanone CAS Name: 1-[4-(3-bromopropoxy)-3-hydroxy-2-propylphenyl]ethanone IUPAC Name: 1-[4-(3-bromopropoxy)-3-hydroxy-2-propylphenyl]ethanone Traditional Name: 1-[4-(3-bromopropoxy)-3-hydroxy-2-propyl-phenyl]ethanone Formula: C14H19BrO3 MolecularWeight: 315.20286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19BrO3/c1-3-5-12-11(10(2)16)6-7-13(14(12)17)18-9-4-8-15/h6-7,17H,3-5,8-9H2,1-2H3