1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-[4-(cyanomethoxy)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-[4-(cyanomethoxy)phenyl]piperidine-4-carboxamide Openeye Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-N-[4-(cyanomethoxy)phenyl]piperidine-4-carboxamide CAS Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-N-[4-(cyanomethoxy)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-N-[4-(cyanomethoxy)phenyl]piperidine-4-carboxamide Traditional Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-N-[4-(cyanomethoxy)phenyl]isonipecotamide Formula: C20H19ClFN3O4S MolecularWeight: 451.898963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)OCC#N)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)OCC#N)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C20H19ClFN3O4S/c21-18-13-17(5-6-19(18)22)30(27,28)25-10-7-14(8-11-25)20(26)24-15-1-3-16(4-2-15)29-12-9-23/h1-6,13-14H,7-8,10-12H2,(H,24,26)