(2S)-1-(2,5-dimethylphenoxy)-3-morpholin-4-ium-4-yl-propan-2-ol

Systemtic Name: (2S)-1-(2,5-dimethylphenoxy)-3-morpholin-4-ium-4-yl-propan-2-ol Openeye Name: (2S)-1-(2,5-dimethylphenoxy)-3-morpholin-4-ium-4-yl-propan-2-ol CAS Name: (2S)-1-(2,5-dimethylphenoxy)-3-(4-morpholin-4-iumyl)-2-propanol IUPAC Name: (2S)-1-(2,5-dimethylphenoxy)-3-morpholin-4-ium-4-ylpropan-2-ol Traditional Name: (2S)-1-(2,5-dimethylphenoxy)-3-morpholin-4-ium-4-yl-propan-2-ol Formula: C15H24NO3+ MolecularWeight: 266.35596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(C[NH+]2CCOCC2)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC[C@H](C[NH+]2CCOCC2)O

InChI

InChI=1S/C15H23NO3/c1-12-3-4-13(2)15(9-12)19-11-14(17)10-16-5-7-18-8-6-16/h3-4,9,14,17H,5-8,10-11H2,1-2H3/p+1/t14-/m0/s1