1-[4-(3-bromanyl-2-oxidanyl-propoxy)-3-(propoxymethyl)phenyl]propan-1-one

Systemtic Name: 1-[4-(3-bromanyl-2-oxidanyl-propoxy)-3-(propoxymethyl)phenyl]propan-1-one Openeye Name: 1-[4-(3-bromo-2-hydroxy-propoxy)-3-(propoxymethyl)phenyl]propan-1-one CAS Name: 1-[4-(3-bromo-2-hydroxypropoxy)-3-(propoxymethyl)phenyl]-1-propanone IUPAC Name: 1-[4-(3-bromo-2-hydroxypropoxy)-3-(propoxymethyl)phenyl]propan-1-one Traditional Name: 1-[4-(3-bromo-2-hydroxy-propoxy)-3-(propoxymethyl)phenyl]propan-1-one Formula: C16H23BrO4 MolecularWeight: 359.25542

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCC1=C(C=CC(=C1)C(=O)CC)OCC(CBr)O

Isomeric SMILES

CCCOCC1=C(C=CC(=C1)C(=O)CC)OCC(CBr)O

InChI

InChI=1S/C16H23BrO4/c1-3-7-20-10-13-8-12(15(19)4-2)5-6-16(13)21-11-14(18)9-17/h5-6,8,14,18H,3-4,7,9-11H2,1-2H3