N-[(3-bromanyl-4,5-dimethoxy-phenyl)methyl]-2,2,2-tris(fluoranyl)ethanamine

Systemtic Name: N-[(3-bromanyl-4,5-dimethoxy-phenyl)methyl]-2,2,2-tris(fluoranyl)ethanamine Openeye Name: N-[(3-bromo-4,5-dimethoxy-phenyl)methyl]-2,2,2-trifluoro-ethanamine CAS Name: N-[(3-bromo-4,5-dimethoxyphenyl)methyl]-2,2,2-trifluoroethanamine IUPAC Name: N-[(3-bromo-4,5-dimethoxyphenyl)methyl]-2,2,2-trifluoroethanamine Traditional Name: (3-bromo-4,5-dimethoxy-benzyl)-(2,2,2-trifluoroethyl)amine Formula: C11H13BrF3NO2 MolecularWeight: 328.12563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNCC(F)(F)F)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)CNCC(F)(F)F)Br)OC

InChI

InChI=1S/C11H13BrF3NO2/c1-17-9-4-7(3-8(12)10(9)18-2)5-16-6-11(13,14)15/h3-4,16H,5-6H2,1-2H3