cyclooctyl-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]azanium

Systemtic Name: cyclooctyl-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]azanium Openeye Name: cyclooctyl-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]ammonium CAS Name: cyclooctyl-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]ammonium IUPAC Name: cyclooctyl-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]azanium Traditional Name: cyclooctyl-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]ammonium Formula: C17H26NO2+ MolecularWeight: 276.39384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)[NH2+]CC2COC3=CC=CC=C3O2

Isomeric SMILES

C1CCCC(CCC1)[NH2+]C[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C17H25NO2/c1-2-4-8-14(9-5-3-1)18-12-15-13-19-16-10-6-7-11-17(16)20-15/h6-7,10-11,14-15,18H,1-5,8-9,12-13H2/p+1/t15-/m0/s1