N-[4-fluoranyl-3-(trifluoromethyl)phenyl]-1-(2-methoxy-5-methyl-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-fluoranyl-3-(trifluoromethyl)phenyl]-1-(2-methoxy-5-methyl-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(2-methoxy-5-methyl-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(2-methoxy-5-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(2-methoxy-5-methyl-phenyl)sulfonyl-isonipecotamide Formula: C21H22F4N2O4S MolecularWeight: 474.468993

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)F)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)F)C(F)(F)F

InChI

InChI=1S/C21H22F4N2O4S/c1-13-3-6-18(31-2)19(11-13)32(29,30)27-9-7-14(8-10-27)20(28)26-15-4-5-17(22)16(12-15)21(23,24)25/h3-6,11-12,14H,7-10H2,1-2H3,(H,26,28)