1-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2,2,2-tris(fluoranyl)-N-methyl-ethanamine

Systemtic Name: 1-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2,2,2-tris(fluoranyl)-N-methyl-ethanamine Openeye Name: 1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2,2,2-trifluoro-N-methyl-ethanamine CAS Name: 1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2,2,2-trifluoro-N-methylethanamine IUPAC Name: 1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2,2,2-trifluoro-N-methylethanamine Traditional Name: [1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2,2,2-trifluoro-ethyl]-methyl-amine Formula: C12H13BrF3NO2 MolecularWeight: 340.13633

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Descriptors Computed from Structure

Canonical SMILES:

CNC(C1=CC2=C(C=C1Br)OCCCO2)C(F)(F)F

Isomeric SMILES

CNC(C1=CC2=C(C=C1Br)OCCCO2)C(F)(F)F

InChI

InChI=1S/C12H13BrF3NO2/c1-17-11(12(14,15)16)7-5-9-10(6-8(7)13)19-4-2-3-18-9/h5-6,11,17H,2-4H2,1H3