2-chloranyl-5-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-benzoate

Systemtic Name: 2-chloranyl-5-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-benzoate Openeye Name: 2-chloro-5-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-benzoate CAS Name: 2-chloro-5-[[(2S,6S)-2,6-dimethyl-4-morpholinyl]sulfonyl]benzoate IUPAC Name: 2-chloro-5-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate Traditional Name: 2-chloro-5-[(2S,6S)-2,6-dimethylmorpholino]sulfonyl-benzoate Formula: C13H15ClNO5S- MolecularWeight: 332.7799

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)[O-]

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C13H16ClNO5S/c1-8-6-15(7-9(2)20-8)21(18,19)10-3-4-12(14)11(5-10)13(16)17/h3-5,8-9H,6-7H2,1-2H3,(H,16,17)/p-1/t8-,9-/m0/s1