N-[[4-(4-bromanyl-2-fluoranyl-phenoxy)-3-fluoranyl-phenyl]methyl]propan-1-amine

Systemtic Name: N-[[4-(4-bromanyl-2-fluoranyl-phenoxy)-3-fluoranyl-phenyl]methyl]propan-1-amine Openeye Name: N-[[4-(4-bromo-2-fluoro-phenoxy)-3-fluoro-phenyl]methyl]propan-1-amine CAS Name: N-[[4-(4-bromo-2-fluorophenoxy)-3-fluorophenyl]methyl]-1-propanamine IUPAC Name: N-[[4-(4-bromo-2-fluorophenoxy)-3-fluorophenyl]methyl]propan-1-amine Traditional Name: [4-(4-bromo-2-fluoro-phenoxy)-3-fluoro-benzyl]-propyl-amine Formula: C16H16BrF2NO MolecularWeight: 356.205146

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=CC(=C(C=C1)OC2=C(C=C(C=C2)Br)F)F

Isomeric SMILES

CCCNCC1=CC(=C(C=C1)OC2=C(C=C(C=C2)Br)F)F

InChI

InChI=1S/C16H16BrF2NO/c1-2-7-20-10-11-3-5-15(13(18)8-11)21-16-6-4-12(17)9-14(16)19/h3-6,8-9,20H,2,7,10H2,1H3