cyanomethyl 4-chloranyl-3-(2,6-dimethylmorpholin-4-yl)sulfonyl-benzoate

Systemtic Name: cyanomethyl 4-chloranyl-3-(2,6-dimethylmorpholin-4-yl)sulfonyl-benzoate Openeye Name: cyanomethyl 4-chloro-3-(2,6-dimethylmorpholin-4-yl)sulfonyl-benzoate CAS Name: 4-chloro-3-[(2,6-dimethyl-4-morpholinyl)sulfonyl]benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 4-chloro-3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Traditional Name: 4-chloro-3-(2,6-dimethylmorpholino)sulfonyl-benzoic acid cyanomethyl ester Formula: C15H17ClN2O5S MolecularWeight: 372.82388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17ClN2O5S/c1-10-8-18(9-11(2)23-10)24(20,21)14-7-12(3-4-13(14)16)15(19)22-6-5-17/h3-4,7,10-11H,6,8-9H2,1-2H3