[(2S)-3-(4-ethanoylphenoxy)-2-oxidanyl-propyl]-bis(2-hydroxyethyl)azanium

Systemtic Name: [(2S)-3-(4-ethanoylphenoxy)-2-oxidanyl-propyl]-bis(2-hydroxyethyl)azanium Openeye Name: [(2S)-3-(4-acetylphenoxy)-2-hydroxy-propyl]-bis(2-hydroxyethyl)ammonium CAS Name: [(2S)-3-(4-acetylphenoxy)-2-hydroxypropyl]-bis(2-hydroxyethyl)ammonium IUPAC Name: [(2S)-3-(4-acetylphenoxy)-2-hydroxypropyl]-bis(2-hydroxyethyl)azanium Traditional Name: [(2S)-3-(4-acetylphenoxy)-2-hydroxy-propyl]-bis(2-hydroxyethyl)ammonium Formula: C15H24NO5+ MolecularWeight: 298.35476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23NO5/c1-12(19)13-2-4-15(5-3-13)21-11-14(20)10-16(6-8-17)7-9-18/h2-5,14,17-18,20H,6-11H2,1H3/p+1/t14-/m0/s1