[(2S,3S)-3-azido-4,4,4-tris(fluoranyl)-1-oxidanyl-butan-2-yl] benzoate

Systemtic Name: [(2S,3S)-3-azido-4,4,4-tris(fluoranyl)-1-oxidanyl-butan-2-yl] benzoate Openeye Name: [(1S,2S)-2-azido-3,3,3-trifluoro-1-(hydroxymethyl)propyl] benzoate CAS Name: benzoic acid [(2S,3S)-3-azido-4,4,4-trifluoro-1-hydroxybutan-2-yl] ester IUPAC Name: [(2S,3S)-3-azido-4,4,4-trifluoro-1-hydroxybutan-2-yl] benzoate Traditional Name: benzoic acid [(1S,2S)-2-azido-3,3,3-trifluoro-1-methylol-propyl] ester Formula: C11H10F3N3O3 MolecularWeight: 289.21061

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC(CO)C(C(F)(F)F)N=[N+]=[N-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)O[C@H](CO)[C@@H](C(F)(F)F)N=[N+]=[N-]

InChI

InChI=1S/C11H10F3N3O3/c12-11(13,14)9(16-17-15)8(6-18)20-10(19)7-4-2-1-3-5-7/h1-5,8-9,18H,6H2/t8-,9+/m1/s1