N-[3,5-bis(trifluoromethyl)phenyl]-1-ethylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-ethylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-ethylsulfonyl-piperidine-4-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-ethylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-ethylsulfonylpiperidine-4-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-esyl-isonipecotamide Formula: C16H18F6N2O3S MolecularWeight: 432.381139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C16H18F6N2O3S/c1-2-28(26,27)24-5-3-10(4-6-24)14(25)23-13-8-11(15(17,18)19)7-12(9-13)16(20,21)22/h7-10H,2-6H2,1H3,(H,23,25)