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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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