(2S)-1-(2,3-dimethylphenoxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2S)-1-(2,3-dimethylphenoxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol Openeye Name: (2S)-1-(2,3-dimethylphenoxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol CAS Name: (2S)-1-(2,3-dimethylphenoxy)-3-(1-pyrrolidin-1-iumyl)-2-propanol IUPAC Name: (2S)-1-(2,3-dimethylphenoxy)-3-pyrrolidin-1-ium-1-ylpropan-2-ol Traditional Name: (2S)-1-(2,3-dimethylphenoxy)-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:

CC1=C(C(=CC=C1)OCC(C[NH+]2CCCC2)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)OC[C@H](C[NH+]2CCCC2)O)C

InChI

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