N-[2-(3-chlorophenyl)-2-oxidanyl-ethyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(3-chlorophenyl)-2-oxidanyl-ethyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(3-chlorophenyl)-2-hydroxy-ethyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(3-chlorophenyl)-2-hydroxyethyl]-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(3-chlorophenyl)-2-hydroxyethyl]-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(3-chlorophenyl)-2-hydroxy-ethyl]-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C20H22ClFN2O4S MolecularWeight: 440.916083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC(C2=CC(=CC=C2)Cl)O)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCC1C(=O)NCC(C2=CC(=CC=C2)Cl)O)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22ClFN2O4S/c21-16-3-1-2-15(12-16)19(25)13-23-20(26)14-8-10-24(11-9-14)29(27,28)18-6-4-17(22)5-7-18/h1-7,12,14,19,25H,8-11,13H2,(H,23,26)