(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-pyrrolidin-1-ium

Systemtic Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-pyrrolidin-1-ium Openeye Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-pyrrolidin-1-ium CAS Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethylpyrrolidin-1-ium IUPAC Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethylpyrrolidin-1-ium Traditional Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-pyrrolidin-1-ium Formula: C14H20NO2+ MolecularWeight: 234.3141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC[NH+]1CCC[C@H]1C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C14H19NO2/c1-2-15-7-3-4-12(15)11-5-6-13-14(10-11)17-9-8-16-13/h5-6,10,12H,2-4,7-9H2,1H3/p+1/t12-/m0/s1