[(2S,3S)-2-ethoxy-5-oxidanylidene-oxolan-3-yl]-[(1R)-1-phenylethyl]azanium; 2,2,2-tris(chloranyl)ethanoate

Systemtic Name: [(2S,3S)-2-ethoxy-5-oxidanylidene-oxolan-3-yl]-[(1R)-1-phenylethyl]azanium; 2,2,2-tris(chloranyl)ethanoate Openeye Name: [(2S,3S)-2-ethoxy-5-oxo-tetrahydrofuran-3-yl]-[(1R)-1-phenylethyl]ammonium; 2,2,2-trichloroacetate CAS Name: [(2S,3S)-2-ethoxy-5-oxo-3-oxolanyl]-[(1R)-1-phenylethyl]ammonium; 2,2,2-trichloroacetate IUPAC Name: [(2S,3S)-2-ethoxy-5-oxooxolan-3-yl]-[(1R)-1-phenylethyl]azanium; 2,2,2-trichloroacetate Traditional Name: [(2S,3S)-2-ethoxy-5-keto-tetrahydrofuran-3-yl]-[(1R)-1-phenylethyl]ammonium; 2,2,2-trichloroacetate Formula: C16H20Cl3NO5 MolecularWeight: 412.6927

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C(CC(=O)O1)[NH2+]C(C)C2=CC=CC=C2.C(=O)(C(Cl)(Cl)Cl)[O-]

Isomeric SMILES

CCO[C@@H]1[C@H](CC(=O)O1)[NH2+][C@H](C)C2=CC=CC=C2.C(=O)(C(Cl)(Cl)Cl)[O-]

InChI

InChI=1S/C14H19NO3.C2HCl3O2/c1-3-17-14-12(9-13(16)18-14)15-10(2)11-7-5-4-6-8-11;3-2(4,5)1(6)7/h4-8,10,12,14-15H,3,9H2,1-2H3;(H,6,7)/t10-,12+,14+;/m1./s1