N-(8-bromanyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-1-azabicyclo[2.2.2]octan-3-amine

Systemtic Name: N-(8-bromanyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-1-azabicyclo[2.2.2]octan-3-amine Openeye Name: N-(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)quinuclidin-3-amine CAS Name: N-(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-1-azabicyclo[2.2.2]octan-3-amine IUPAC Name: N-(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-1-azabicyclo[2.2.2]octan-3-amine Traditional Name: (8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-quinuclidin-3-yl-amine Formula: C17H23BrN2O MolecularWeight: 351.28132

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C=C(C=C2)Br)OC1)NC3CN4CCC3CC4

Isomeric SMILES

C1CC(C2=C(C=C(C=C2)Br)OC1)NC3CN4CCC3CC4

InChI

InChI=1S/C17H23BrN2O/c18-13-3-4-14-15(2-1-9-21-17(14)10-13)19-16-11-20-7-5-12(16)6-8-20/h3-4,10,12,15-16,19H,1-2,5-9,11H2