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

Systemtic Name: 2-hydroxyethyl-methyl-[[3-[(2S)-3-morpholin-4-ium-4-yl-2-oxidanyl-propoxy]phenyl]methyl]azanium Openeye Name: 2-hydroxyethyl-[[3-[(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]phenyl]methyl]-methyl-ammonium CAS Name: 2-hydroxyethyl-[[3-[(2S)-2-hydroxy-3-(4-morpholin-4-iumyl)propoxy]phenyl]methyl]-methylammonium IUPAC Name: 2-hydroxyethyl-[[3-[(2S)-2-hydroxy-3-morpholin-4-ium-4-ylpropoxy]phenyl]methyl]-methylazanium Traditional Name: 2-hydroxyethyl-[3-[(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]benzyl]-methyl-ammonium Formula: C17H30N2O4+2 MolecularWeight: 326.4311

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28N2O4/c1-18(5-8-20)12-15-3-2-4-17(11-15)23-14-16(21)13-19-6-9-22-10-7-19/h2-4,11,16,20-21H,5-10,12-14H2,1H3/p+2/t16-/m0/s1