N-(2-chloranyl-4-fluoranyl-phenyl)-1-(3-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-chloranyl-4-fluoranyl-phenyl)-1-(3-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(3-acetylphenyl)sulfonyl-N-(2-chloro-4-fluoro-phenyl)piperidine-4-carboxamide CAS Name: 1-(3-acetylphenyl)sulfonyl-N-(2-chloro-4-fluorophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(3-acetylphenyl)sulfonyl-N-(2-chloro-4-fluorophenyl)piperidine-4-carboxamide Traditional Name: 1-(3-acetylphenyl)sulfonyl-N-(2-chloro-4-fluoro-phenyl)isonipecotamide Formula: C20H20ClFN2O4S MolecularWeight: 438.900203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C20H20ClFN2O4S/c1-13(25)15-3-2-4-17(11-15)29(27,28)24-9-7-14(8-10-24)20(26)23-19-6-5-16(22)12-18(19)21/h2-6,11-12,14H,7-10H2,1H3,(H,23,26)