(2-chloranyl-6-fluoranyl-phenyl)methyl 2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 2-morpholino-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-(4-morpholinyl)-5-(1-piperidinylsulfonyl)benzoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 2-morpholin-4-yl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-morpholino-5-piperidinosulfonyl-benzoic acid (2-chloro-6-fluoro-benzyl) ester Formula: C23H26ClFN2O5S MolecularWeight: 496.979343

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCOCC3)C(=O)OCC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCOCC3)C(=O)OCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C23H26ClFN2O5S/c24-20-5-4-6-21(25)19(20)16-32-23(28)18-15-17(33(29,30)27-9-2-1-3-10-27)7-8-22(18)26-11-13-31-14-12-26/h4-8,15H,1-3,9-14,16H2