3-chloranyl-2,4,6-tris(fluoranyl)-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)benzenesulfonamide

Systemtic Name: 3-chloranyl-2,4,6-tris(fluoranyl)-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)benzenesulfonamide Openeye Name: 3-chloro-2,4,6-trifluoro-N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]benzenesulfonamide CAS Name: 3-chloro-2,4,6-trifluoro-N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]benzenesulfonamide IUPAC Name: 3-chloro-2,4,6-trifluoro-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)benzenesulfonamide Traditional Name: 3-chloro-2,4,6-trifluoro-N-(4-methoxy-3-piperidinosulfonyl-phenyl)benzenesulfonamide Formula: C18H18ClF3N2O5S2 MolecularWeight: 498.92413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NS(=O)(=O)C2=C(C(=C(C=C2F)F)Cl)F)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)NS(=O)(=O)C2=C(C(=C(C=C2F)F)Cl)F)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H18ClF3N2O5S2/c1-29-14-6-5-11(9-15(14)31(27,28)24-7-3-2-4-8-24)23-30(25,26)18-13(21)10-12(20)16(19)17(18)22/h5-6,9-10,23H,2-4,7-8H2,1H3