(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) 2-fluoranyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) 2-fluoranyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (1-methyl-2-morpholino-2-oxo-ethyl) 2-fluoro-5-morpholinosulfonyl-benzoate CAS Name: 2-fluoro-5-(4-morpholinylsulfonyl)benzoic acid [1-(4-morpholinyl)-1-oxopropan-2-yl] ester IUPAC Name: (1-morpholin-4-yl-1-oxopropan-2-yl) 2-fluoro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-fluoro-5-morpholinosulfonyl-benzoic acid (2-keto-1-methyl-2-morpholino-ethyl) ester Formula: C18H23FN2O7S MolecularWeight: 430.447823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCOCC1)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)F

Isomeric SMILES

CC(C(=O)N1CCOCC1)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)F

InChI

InChI=1S/C18H23FN2O7S/c1-13(17(22)20-4-8-26-9-5-20)28-18(23)15-12-14(2-3-16(15)19)29(24,25)21-6-10-27-11-7-21/h2-3,12-13H,4-11H2,1H3