8-[3,5-bis(bromanyl)-4-phenyl-phenoxy]octan-1-amine

Systemtic Name: 8-[3,5-bis(bromanyl)-4-phenyl-phenoxy]octan-1-amine Openeye Name: 8-(3,5-dibromo-4-phenyl-phenoxy)octan-1-amine CAS Name: 8-(3,5-dibromo-4-phenylphenoxy)-1-octanamine IUPAC Name: 8-(3,5-dibromo-4-phenylphenoxy)octan-1-amine Traditional Name: 8-(3,5-dibromo-4-phenyl-phenoxy)octylamine Formula: C20H25Br2NO MolecularWeight: 455.2266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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