(2S)-1-morpholin-4-ium-4-yl-3-[(3,4,5-trimethoxyphenyl)methoxy]propan-2-ol

Systemtic Name: (2S)-1-morpholin-4-ium-4-yl-3-[(3,4,5-trimethoxyphenyl)methoxy]propan-2-ol Openeye Name: (2S)-1-morpholin-4-ium-4-yl-3-[(3,4,5-trimethoxyphenyl)methoxy]propan-2-ol CAS Name: (2S)-1-(4-morpholin-4-iumyl)-3-[(3,4,5-trimethoxyphenyl)methoxy]-2-propanol IUPAC Name: (2S)-1-morpholin-4-ium-4-yl-3-[(3,4,5-trimethoxyphenyl)methoxy]propan-2-ol Traditional Name: (2S)-1-morpholin-4-ium-4-yl-3-(3,4,5-trimethoxybenzyl)oxy-propan-2-ol Formula: C17H28NO6+ MolecularWeight: 342.40732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)COCC(C[NH+]2CCOCC2)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)COC[C@H](C[NH+]2CCOCC2)O

InChI

InChI=1S/C17H27NO6/c1-20-15-8-13(9-16(21-2)17(15)22-3)11-24-12-14(19)10-18-4-6-23-7-5-18/h8-9,14,19H,4-7,10-12H2,1-3H3/p+1/t14-/m0/s1