(2S)-1-[2-[(2-morpholin-4-ylethylamino)methyl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2S)-1-[2-[(2-morpholin-4-ylethylamino)methyl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol Openeye Name: (2S)-1-[2-[(2-morpholinoethylamino)methyl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol CAS Name: (2S)-1-[2-[[2-(4-morpholinyl)ethylamino]methyl]phenoxy]-3-(1-piperidin-1-iumyl)-2-propanol IUPAC Name: (2S)-1-[2-[(2-morpholin-4-ylethylamino)methyl]phenoxy]-3-piperidin-1-ium-1-ylpropan-2-ol Traditional Name: (2S)-1-[2-[(2-morpholinoethylamino)methyl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol Formula: C21H36N3O3+ MolecularWeight: 378.52884

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(COC2=CC=CC=C2CNCCN3CCOCC3)O

Isomeric SMILES

C1CC[NH+](CC1)C[C@@H](COC2=CC=CC=C2CNCCN3CCOCC3)O

InChI

InChI=1S/C21H35N3O3/c25-20(17-24-9-4-1-5-10-24)18-27-21-7-3-2-6-19(21)16-22-8-11-23-12-14-26-15-13-23/h2-3,6-7,20,22,25H,1,4-5,8-18H2/p+1/t20-/m0/s1