[2-(3-chlorophenyl)-2-oxidanylidene-ethyl] 2-fluoranyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [2-(3-chlorophenyl)-2-oxidanylidene-ethyl] 2-fluoranyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: [2-(3-chlorophenyl)-2-oxo-ethyl] 2-fluoro-5-morpholinosulfonyl-benzoate CAS Name: 2-fluoro-5-(4-morpholinylsulfonyl)benzoic acid [2-(3-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-chlorophenyl)-2-oxoethyl] 2-fluoro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-fluoro-5-morpholinosulfonyl-benzoic acid [2-(3-chlorophenyl)-2-keto-ethyl] ester Formula: C19H17ClFNO6S MolecularWeight: 441.857783

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)OCC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)OCC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H17ClFNO6S/c20-14-3-1-2-13(10-14)18(23)12-28-19(24)16-11-15(4-5-17(16)21)29(25,26)22-6-8-27-9-7-22/h1-5,10-11H,6-9,12H2