[(2R,3S,4R,5R)-3-acetyloxy-2-(acetyloxymethyl)-5-azido-6-bromanyl-oxan-4-yl] 2-chloranylethanoate

Systemtic Name: [(2R,3S,4R,5R)-3-acetyloxy-2-(acetyloxymethyl)-5-azido-6-bromanyl-oxan-4-yl] 2-chloranylethanoate Openeye Name: [(2R,3S,4R,5R)-3-acetoxy-2-(acetoxymethyl)-5-azido-6-bromo-tetrahydropyran-4-yl] 2-chloroacetate CAS Name: 2-chloroacetic acid [(2R,3S,4R,5R)-3-acetyloxy-2-(acetyloxymethyl)-5-azido-6-bromo-4-oxanyl] ester IUPAC Name: [(2R,3S,4R,5R)-3-acetyloxy-2-(acetyloxymethyl)-5-azido-6-bromooxan-4-yl] 2-chloroacetate Traditional Name: 2-chloroacetic acid [(2R,3S,4R,5R)-3-acetoxy-2-(acetoxymethyl)-5-azido-6-bromo-tetrahydropyran-4-yl] ester Formula: C12H15BrClN3O7 MolecularWeight: 428.6204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)Br)N=[N+]=[N-])OC(=O)CCl)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H](C(O1)Br)N=[N+]=[N-])OC(=O)CCl)OC(=O)C

InChI

InChI=1S/C12H15BrClN3O7/c1-5(18)21-4-7-10(22-6(2)19)11(24-8(20)3-14)9(16-17-15)12(13)23-7/h7,9-12H,3-4H2,1-2H3/t7-,9-,10-,11-,12?/m1/s1