N-[3-(2-fluoranylphenoxy)propyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(2-fluoranylphenoxy)propyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(2-fluorophenoxy)propyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(2-fluorophenoxy)propyl]-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(2-fluorophenoxy)propyl]-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(2-fluorophenoxy)propyl]-1-mesitylsulfonyl-isonipecotamide Formula: C24H31FN2O4S MolecularWeight: 462.577343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCCCOC3=CC=CC=C3F)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCCCOC3=CC=CC=C3F)C

InChI

InChI=1S/C24H31FN2O4S/c1-17-15-18(2)23(19(3)16-17)32(29,30)27-12-9-20(10-13-27)24(28)26-11-6-14-31-22-8-5-4-7-21(22)25/h4-5,7-8,15-16,20H,6,9-14H2,1-3H3,(H,26,28)