1-(3-bromanyl-4-methoxy-phenyl)-2-octoxy-ethanone

Systemtic Name: 1-(3-bromanyl-4-methoxy-phenyl)-2-octoxy-ethanone Openeye Name: 1-(3-bromo-4-methoxy-phenyl)-2-octoxy-ethanone CAS Name: 1-(3-bromo-4-methoxyphenyl)-2-octoxyethanone IUPAC Name: 1-(3-bromo-4-methoxyphenyl)-2-octoxyethanone Traditional Name: 1-(3-bromo-4-methoxy-phenyl)-2-octoxy-ethanone Formula: C17H25BrO3 MolecularWeight: 357.2826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC(=O)C1=CC(=C(C=C1)OC)Br

Isomeric SMILES

CCCCCCCCOCC(=O)C1=CC(=C(C=C1)OC)Br

InChI

InChI=1S/C17H25BrO3/c1-3-4-5-6-7-8-11-21-13-16(19)14-9-10-17(20-2)15(18)12-14/h9-10,12H,3-8,11,13H2,1-2H3