2-(4-bromophenyl)-1-(5-hexyl-4-methoxy-2-oxidanyl-phenyl)ethanone

Systemtic Name: 2-(4-bromophenyl)-1-(5-hexyl-4-methoxy-2-oxidanyl-phenyl)ethanone Openeye Name: 2-(4-bromophenyl)-1-(5-hexyl-2-hydroxy-4-methoxy-phenyl)ethanone CAS Name: 2-(4-bromophenyl)-1-(5-hexyl-2-hydroxy-4-methoxyphenyl)ethanone IUPAC Name: 2-(4-bromophenyl)-1-(5-hexyl-2-hydroxy-4-methoxyphenyl)ethanone Traditional Name: 2-(4-bromophenyl)-1-(5-hexyl-2-hydroxy-4-methoxy-phenyl)ethanone Formula: C21H25BrO3 MolecularWeight: 405.3254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C(C(=C1)C(=O)CC2=CC=C(C=C2)Br)O)OC

Isomeric SMILES

CCCCCCC1=C(C=C(C(=C1)C(=O)CC2=CC=C(C=C2)Br)O)OC

InChI

InChI=1S/C21H25BrO3/c1-3-4-5-6-7-16-13-18(20(24)14-21(16)25-2)19(23)12-15-8-10-17(22)11-9-15/h8-11,13-14,24H,3-7,12H2,1-2H3