2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-pyridin-4-ylethyl]azanium

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-pyridin-4-ylethyl]azanium Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-(4-pyridyl)ethyl]ammonium CAS Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-pyridin-4-ylethyl]ammonium IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-pyridin-4-ylethyl]azanium Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(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+]CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C[C@@H](C1=CC=NC=C1)[NH2+]CC2=CC3=C(C=C2)OCCO3

InChI

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