methyl 1-[4-[(4-fluorophenyl)-methylsulfonyl-amino]butanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[4-[(4-fluorophenyl)-methylsulfonyl-amino]butanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[4-(4-fluoro-N-methylsulfonyl-anilino)butanoyl]piperidine-4-carboxylate CAS Name: 1-[4-(4-fluoro-N-methylsulfonylanilino)-1-oxobutyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-(4-fluoro-N-methylsulfonylanilino)butanoyl]piperidine-4-carboxylate Traditional Name: 1-[4-(4-fluoro-N-mesyl-anilino)butanoyl]isonipecotic acid methyl ester Formula: C18H25FN2O5S MolecularWeight: 400.464903

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CCCN(C2=CC=C(C=C2)F)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CCCN(C2=CC=C(C=C2)F)S(=O)(=O)C

InChI

InChI=1S/C18H25FN2O5S/c1-26-18(23)14-9-12-20(13-10-14)17(22)4-3-11-21(27(2,24)25)16-7-5-15(19)6-8-16/h5-8,14H,3-4,9-13H2,1-2H3