(2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate

Systemtic Name: (2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Openeye Name: (2-methoxy-2-oxo-1-phenyl-ethyl) 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate CAS Name: 4-[(2,6-dimethyl-4-morpholinyl)sulfonyl]benzoic acid (2-methoxy-2-oxo-1-phenylethyl) ester IUPAC Name: (2-methoxy-2-oxo-1-phenylethyl) 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Traditional Name: 4-(2,6-dimethylmorpholino)sulfonylbenzoic acid (2-keto-2-methoxy-1-phenyl-ethyl) ester Formula: C22H25NO7S MolecularWeight: 447.5014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO7S/c1-15-13-23(14-16(2)29-15)31(26,27)19-11-9-18(10-12-19)21(24)30-20(22(25)28-3)17-7-5-4-6-8-17/h4-12,15-16,20H,13-14H2,1-3H3