tert-butyl-[(2S)-3-(2-ethanoylphenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: tert-butyl-[(2S)-3-(2-ethanoylphenoxy)-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-3-(2-acetylphenoxy)-2-hydroxy-propyl]-tert-butyl-ammonium CAS Name: [(2S)-3-(2-acetylphenoxy)-2-hydroxypropyl]-tert-butylammonium IUPAC Name: [(2S)-3-(2-acetylphenoxy)-2-hydroxypropyl]-tert-butylazanium Traditional Name: [(2S)-3-(2-acetylphenoxy)-2-hydroxy-propyl]-tert-butyl-ammonium Formula: C15H24NO3+ MolecularWeight: 266.35596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23NO3/c1-11(17)13-7-5-6-8-14(13)19-10-12(18)9-16-15(2,3)4/h5-8,12,16,18H,9-10H2,1-4H3/p+1/t12-/m0/s1