[(2S,3R,4S,5S,6R)-5-azido-2-methoxy-6-methyl-3-phenylmethoxy-oxan-4-yl] benzoate

Systemtic Name: [(2S,3R,4S,5S,6R)-5-azido-2-methoxy-6-methyl-3-phenylmethoxy-oxan-4-yl] benzoate Openeye Name: [(2S,3R,4S,5S,6R)-5-azido-3-benzyloxy-2-methoxy-6-methyl-tetrahydropyran-4-yl] benzoate CAS Name: benzoic acid [(2S,3R,4S,5S,6R)-5-azido-2-methoxy-6-methyl-3-phenylmethoxy-4-oxanyl] ester IUPAC Name: [(2S,3R,4S,5S,6R)-5-azido-2-methoxy-6-methyl-3-phenylmethoxyoxan-4-yl] benzoate Traditional Name: benzoic acid [(2S,3R,4S,5S,6R)-5-azido-3-benzoxy-2-methoxy-6-methyl-tetrahydropyran-4-yl] ester Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC)OCC2=CC=CC=C2)OC(=O)C3=CC=CC=C3)N=[N+]=[N-]

Isomeric SMILES

C[C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)OC)OCC2=CC=CC=C2)OC(=O)C3=CC=CC=C3)N=[N+]=[N-]

InChI

InChI=1S/C21H23N3O5/c1-14-17(23-24-22)18(29-20(25)16-11-7-4-8-12-16)19(21(26-2)28-14)27-13-15-9-5-3-6-10-15/h3-12,14,17-19,21H,13H2,1-2H3/t14-,17+,18+,19-,21+/m1/s1