[(2S)-3-(2-ethanoylphenoxy)-2-oxidanyl-propyl]-(2-methyl-1-oxidanyl-propan-2-yl)azanium

Systemtic Name: [(2S)-3-(2-ethanoylphenoxy)-2-oxidanyl-propyl]-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: [(2S)-3-(2-acetylphenoxy)-2-hydroxy-propyl]-(2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: [(2S)-3-(2-acetylphenoxy)-2-hydroxypropyl]-(1-hydroxy-2-methylpropan-2-yl)ammonium IUPAC Name: [(2S)-3-(2-acetylphenoxy)-2-hydroxypropyl]-(1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: [(2S)-3-(2-acetylphenoxy)-2-hydroxy-propyl]-(2-hydroxy-1,1-dimethyl-ethyl)ammonium Formula: C15H24NO4+ MolecularWeight: 282.35536

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1OCC(C[NH2+]C(C)(C)CO)O

Isomeric SMILES

CC(=O)C1=CC=CC=C1OC[C@H](C[NH2+]C(C)(C)CO)O

InChI

InChI=1S/C15H23NO4/c1-11(18)13-6-4-5-7-14(13)20-9-12(19)8-16-15(2,3)10-17/h4-7,12,16-17,19H,8-10H2,1-3H3/p+1/t12-/m0/s1