ethyl 1-(2-fluoranyl-5-morpholin-4-ylsulfonyl-phenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-fluoranyl-5-morpholin-4-ylsulfonyl-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(2-fluoro-5-morpholinosulfonyl-benzoyl)piperidine-4-carboxylate CAS Name: 1-[[2-fluoro-5-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-fluoro-5-morpholin-4-ylsulfonylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-(2-fluoro-5-morpholinosulfonyl-benzoyl)isonipecotic acid ethyl ester Formula: C19H25FN2O6S MolecularWeight: 428.475003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25FN2O6S/c1-2-28-19(24)14-5-7-21(8-6-14)18(23)16-13-15(3-4-17(16)20)29(25,26)22-9-11-27-12-10-22/h3-4,13-14H,2,5-12H2,1H3