N-[3,5-bis(fluoranyl)phenyl]-1-(4-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3,5-bis(fluoranyl)phenyl]-1-(4-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-acetylphenyl)sulfonyl-N-(3,5-difluorophenyl)piperidine-4-carboxamide CAS Name: 1-(4-acetylphenyl)sulfonyl-N-(3,5-difluorophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-acetylphenyl)sulfonyl-N-(3,5-difluorophenyl)piperidine-4-carboxamide Traditional Name: 1-(4-acetylphenyl)sulfonyl-N-(3,5-difluorophenyl)isonipecotamide Formula: C20H20F2N2O4S MolecularWeight: 422.445606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20F2N2O4S/c1-13(25)14-2-4-19(5-3-14)29(27,28)24-8-6-15(7-9-24)20(26)23-18-11-16(21)10-17(22)12-18/h2-5,10-12,15H,6-9H2,1H3,(H,23,26)