3-(4-bromanyl-2-fluoranyl-phenyl)-3-(3-iodanylphenoxy)-N-(phenylmethyl)propan-1-amine

Systemtic Name: 3-(4-bromanyl-2-fluoranyl-phenyl)-3-(3-iodanylphenoxy)-N-(phenylmethyl)propan-1-amine Openeye Name: N-benzyl-3-(4-bromo-2-fluoro-phenyl)-3-(3-iodophenoxy)propan-1-amine CAS Name: 3-(4-bromo-2-fluorophenyl)-3-(3-iodophenoxy)-N-(phenylmethyl)-1-propanamine IUPAC Name: N-benzyl-3-(4-bromo-2-fluorophenyl)-3-(3-iodophenoxy)propan-1-amine Traditional Name: benzyl-[3-(4-bromo-2-fluoro-phenyl)-3-(3-iodophenoxy)propyl]amine Formula: C22H20BrFINO MolecularWeight: 540.207173

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCCC(C2=C(C=C(C=C2)Br)F)OC3=CC(=CC=C3)I

Isomeric SMILES

C1=CC=C(C=C1)CNCCC(C2=C(C=C(C=C2)Br)F)OC3=CC(=CC=C3)I

InChI

InChI=1S/C22H20BrFINO/c23-17-9-10-20(21(24)13-17)22(27-19-8-4-7-18(25)14-19)11-12-26-15-16-5-2-1-3-6-16/h1-10,13-14,22,26H,11-12,15H2