[(2R,3S,4R,5R)-4-acetyloxy-5-azido-3-phenylmethoxy-6-[2,2,2-tris(chloranyl)ethanimidoyloxy]oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3S,4R,5R)-4-acetyloxy-5-azido-3-phenylmethoxy-6-[2,2,2-tris(chloranyl)ethanimidoyloxy]oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3S,4R,5R)-4-acetoxy-5-azido-3-benzyloxy-6-(2,2,2-trichloroethanimidoyl)oxy-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3S,4R,5R)-4-acetyloxy-5-azido-3-phenylmethoxy-6-(2,2,2-trichloro-1-iminoethoxy)-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,4R,5R)-4-acetyloxy-5-azido-3-phenylmethoxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3S,4R,5R)-4-acetoxy-5-azido-3-benzoxy-6-(2,2,2-trichloroacetimidoyl)oxy-tetrahydropyran-2-yl]methyl ester Formula: C19H21Cl3N4O7 MolecularWeight: 523.75164

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OC(=N)C(Cl)(Cl)Cl)N=[N+]=[N-])OC(=O)C)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H](C(O1)OC(=N)C(Cl)(Cl)Cl)N=[N+]=[N-])OC(=O)C)OCC2=CC=CC=C2

InChI

InChI=1S/C19H21Cl3N4O7/c1-10(27)29-9-13-15(30-8-12-6-4-3-5-7-12)16(31-11(2)28)14(25-26-24)17(32-13)33-18(23)19(20,21)22/h3-7,13-17,23H,8-9H2,1-2H3/t13-,14-,15-,16-,17?/m1/s1