N-[1-(1-benzofuran-2-yl)ethyl]-1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(1-benzofuran-2-yl)ethyl]-1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(benzofuran-2-yl)ethyl]-1-(3-chloro-4-fluoro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(2-benzofuranyl)ethyl]-1-(3-chloro-4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(1-benzofuran-2-yl)ethyl]-1-(3-chloro-4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(benzofuran-2-yl)ethyl]-1-(3-chloro-4-fluoro-phenyl)sulfonyl-isonipecotamide Formula: C22H22ClFN2O4S MolecularWeight: 464.937483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2O1)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CC(C1=CC2=CC=CC=C2O1)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C22H22ClFN2O4S/c1-14(21-12-16-4-2-3-5-20(16)30-21)25-22(27)15-8-10-26(11-9-15)31(28,29)17-6-7-19(24)18(23)13-17/h2-7,12-15H,8-11H2,1H3,(H,25,27)