N-(3-chloranyl-4-fluoranyl-phenyl)-1-quinolin-8-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-1-quinolin-8-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-1-(8-quinolylsulfonyl)piperidine-4-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-1-(8-quinolinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-1-quinolin-8-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-1-(8-quinolylsulfonyl)isonipecotamide Formula: C21H19ClFN3O3S MolecularWeight: 447.910263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC(=C(C=C2)F)Cl)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC(=C(C=C2)F)Cl)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H19ClFN3O3S/c22-17-13-16(6-7-18(17)23)25-21(27)15-8-11-26(12-9-15)30(28,29)19-5-1-3-14-4-2-10-24-20(14)19/h1-7,10,13,15H,8-9,11-12H2,(H,25,27)