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

Systemtic Name: [(2R,3R)-3-azido-4,4,4-tris(fluoranyl)-1-phenylmethoxy-butan-2-yl] benzoate Openeye Name: [(1R,2R)-2-azido-1-(benzyloxymethyl)-3,3,3-trifluoro-propyl] benzoate CAS Name: benzoic acid [(2R,3R)-3-azido-4,4,4-trifluoro-1-phenylmethoxybutan-2-yl] ester IUPAC Name: [(2R,3R)-3-azido-4,4,4-trifluoro-1-phenylmethoxybutan-2-yl] benzoate Traditional Name: benzoic acid [(1R,2R)-2-azido-1-(benzoxymethyl)-3,3,3-trifluoro-propyl] ester Formula: C18H16F3N3O3 MolecularWeight: 379.33315

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(C(C(F)(F)F)N=[N+]=[N-])OC(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC[C@@H]([C@H](C(F)(F)F)N=[N+]=[N-])OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H16F3N3O3/c19-18(20,21)16(23-24-22)15(12-26-11-13-7-3-1-4-8-13)27-17(25)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2/t15-,16+/m0/s1