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

Systemtic Name: N-[4-(4-fluoranylphenoxy)butyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-(4-fluorophenoxy)butyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[4-(4-fluorophenoxy)butyl]-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(4-fluorophenoxy)butyl]-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(4-fluorophenoxy)butyl]-1-mesitylsulfonyl-isonipecotamide Formula: C25H33FN2O4S MolecularWeight: 476.603923

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)NCCCCOC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCCCCOC3=CC=C(C=C3)F)C

InChI

InChI=1S/C25H33FN2O4S/c1-18-16-19(2)24(20(3)17-18)33(30,31)28-13-10-21(11-14-28)25(29)27-12-4-5-15-32-23-8-6-22(26)7-9-23/h6-9,16-17,21H,4-5,10-15H2,1-3H3,(H,27,29)