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

Systemtic Name: phenethyl 3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate Openeye Name: phenethyl 3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate CAS Name: 3-[[(2R,6R)-2,6-dimethyl-4-morpholinyl]sulfonyl]benzoic acid phenethyl ester IUPAC Name: phenethyl 3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate Traditional Name: 3-[(2R,6R)-2,6-dimethylmorpholino]sulfonylbenzoic acid phenethyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCCC3=CC=CC=C3

Isomeric SMILES

C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C21H25NO5S/c1-16-14-22(15-17(2)27-16)28(24,25)20-10-6-9-19(13-20)21(23)26-12-11-18-7-4-3-5-8-18/h3-10,13,16-17H,11-12,14-15H2,1-2H3/t16-,17-/m1/s1