(3,3-dimethyl-2-oxidanylidene-butyl) 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate CAS Name: 4-[(2,6-dimethyl-4-morpholinyl)sulfonyl]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Traditional Name: 4-(2,6-dimethylmorpholino)sulfonylbenzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C19H27NO6S MolecularWeight: 397.48578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27NO6S/c1-13-10-20(11-14(2)26-13)27(23,24)16-8-6-15(7-9-16)18(22)25-12-17(21)19(3,4)5/h6-9,13-14H,10-12H2,1-5H3