(2S)-1-(4-ethylphenoxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2S)-1-(4-ethylphenoxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol Openeye Name: (2S)-1-(4-ethylphenoxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol CAS Name: (2S)-1-(4-ethylphenoxy)-3-(1-pyrrolidin-1-iumyl)-2-propanol IUPAC Name: (2S)-1-(4-ethylphenoxy)-3-pyrrolidin-1-ium-1-ylpropan-2-ol Traditional Name: (2S)-1-(4-ethylphenoxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol Formula: C15H24NO2+ MolecularWeight: 250.35656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(C[NH+]2CCCC2)O

Isomeric SMILES

CCC1=CC=C(C=C1)OC[C@H](C[NH+]2CCCC2)O

InChI

InChI=1S/C15H23NO2/c1-2-13-5-7-15(8-6-13)18-12-14(17)11-16-9-3-4-10-16/h5-8,14,17H,2-4,9-12H2,1H3/p+1/t14-/m0/s1