(4-ethanoylphenyl) 4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate

Systemtic Name: (4-ethanoylphenyl) 4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate Openeye Name: (4-acetylphenyl) 4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate CAS Name: 4-[[(2R,6R)-2,6-dimethyl-4-morpholinyl]sulfonyl]benzoic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate Traditional Name: 4-[(2R,6R)-2,6-dimethylmorpholino]sulfonylbenzoic acid (4-acetylphenyl) ester Formula: C21H23NO6S MolecularWeight: 417.47542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H23NO6S/c1-14-12-22(13-15(2)27-14)29(25,26)20-10-6-18(7-11-20)21(24)28-19-8-4-17(5-9-19)16(3)23/h4-11,14-15H,12-13H2,1-3H3/t14-,15-/m1/s1