cyanomethyl 3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate

Systemtic Name: cyanomethyl 3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate Openeye Name: cyanomethyl 3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate CAS Name: 3-[[(2R,6R)-2,6-dimethyl-4-morpholinyl]sulfonyl]benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate Traditional Name: 3-[(2R,6R)-2,6-dimethylmorpholino]sulfonylbenzoic acid cyanomethyl ester Formula: C15H18N2O5S MolecularWeight: 338.37882

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC#N

Isomeric SMILES

C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC#N

InChI

InChI=1S/C15H18N2O5S/c1-11-9-17(10-12(2)22-11)23(19,20)14-5-3-4-13(8-14)15(18)21-7-6-16/h3-5,8,11-12H,7,9-10H2,1-2H3/t11-,12-/m1/s1