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

Systemtic Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(1S)-1-pyridin-2-ylethyl]azanium Openeye Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(1S)-1-(2-pyridyl)ethyl]ammonium CAS Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(1S)-1-(2-pyridinyl)ethyl]ammonium IUPAC Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(1S)-1-pyridin-2-ylethyl]azanium Traditional Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(1S)-1-(2-pyridyl)ethyl]ammonium Formula: C16H19N2O2+ MolecularWeight: 271.33426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=N1)[NH2+]CC2COC3=CC=CC=C3O2

Isomeric SMILES

C[C@@H](C1=CC=CC=N1)[NH2+]C[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C16H18N2O2/c1-12(14-6-4-5-9-17-14)18-10-13-11-19-15-7-2-3-8-16(15)20-13/h2-9,12-13,18H,10-11H2,1H3/p+1/t12-,13-/m0/s1