8-[2,4-bis(bromanyl)-3-phenyl-phenoxy]octan-1-amine

Systemtic Name: 8-[2,4-bis(bromanyl)-3-phenyl-phenoxy]octan-1-amine Openeye Name: 8-(2,4-dibromo-3-phenyl-phenoxy)octan-1-amine CAS Name: 8-(2,4-dibromo-3-phenylphenoxy)-1-octanamine IUPAC Name: 8-(2,4-dibromo-3-phenylphenoxy)octan-1-amine Traditional Name: 8-(2,4-dibromo-3-phenyl-phenoxy)octylamine Formula: C20H25Br2NO MolecularWeight: 455.2266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=CC(=C2Br)OCCCCCCCCN)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=CC(=C2Br)OCCCCCCCCN)Br

InChI

InChI=1S/C20H25Br2NO/c21-17-12-13-18(24-15-9-4-2-1-3-8-14-23)20(22)19(17)16-10-6-5-7-11-16/h5-7,10-13H,1-4,8-9,14-15,23H2