(2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: (2-morpholino-2-oxo-1-phenyl-ethyl) 4-fluoro-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-fluoro-3-(1-piperidinylsulfonyl)benzoic acid [2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxo-1-phenylethyl) 4-fluoro-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-piperidinosulfonyl-benzoic acid (2-keto-2-morpholino-1-phenyl-ethyl) ester Formula: C24H27FN2O6S MolecularWeight: 490.544383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC(C3=CC=CC=C3)C(=O)N4CCOCC4)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC(C3=CC=CC=C3)C(=O)N4CCOCC4)F

InChI

InChI=1S/C24H27FN2O6S/c25-20-10-9-19(17-21(20)34(30,31)27-11-5-2-6-12-27)24(29)33-22(18-7-3-1-4-8-18)23(28)26-13-15-32-16-14-26/h1,3-4,7-10,17,22H,2,5-6,11-16H2