[3-[(2S)-3-morpholin-4-ium-4-yl-2-oxidanyl-propoxy]phenyl]methyl-(3-pyridin-3-yloxypropyl)azanium

Systemtic Name: [3-[(2S)-3-morpholin-4-ium-4-yl-2-oxidanyl-propoxy]phenyl]methyl-(3-pyridin-3-yloxypropyl)azanium Openeye Name: [3-[(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]phenyl]methyl-[3-(3-pyridyloxy)propyl]ammonium CAS Name: [3-[(2S)-2-hydroxy-3-(4-morpholin-4-iumyl)propoxy]phenyl]methyl-[3-(3-pyridinyloxy)propyl]ammonium IUPAC Name: [3-[(2S)-2-hydroxy-3-morpholin-4-ium-4-ylpropoxy]phenyl]methyl-(3-pyridin-3-yloxypropyl)azanium Traditional Name: [3-[(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]benzyl]-[3-(3-pyridyloxy)propyl]ammonium Formula: C22H33N3O4+2 MolecularWeight: 403.51512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(COC2=CC=CC(=C2)C[NH2+]CCCOC3=CN=CC=C3)O

Isomeric SMILES

C1COCC[NH+]1C[C@@H](COC2=CC=CC(=C2)C[NH2+]CCCOC3=CN=CC=C3)O

InChI

InChI=1S/C22H31N3O4/c26-20(17-25-9-12-27-13-10-25)18-29-21-5-1-4-19(14-21)15-23-8-3-11-28-22-6-2-7-24-16-22/h1-2,4-7,14,16,20,23,26H,3,8-13,15,17-18H2/p+2/t20-/m0/s1