N-[4-[6-(2,5-dihydropyrrol-1-yl)hexoxy]phenyl]-4-fluoranyl-N-methyl-benzenesulfonamide

Systemtic Name: N-[4-[6-(2,5-dihydropyrrol-1-yl)hexoxy]phenyl]-4-fluoranyl-N-methyl-benzenesulfonamide Openeye Name: N-[4-[6-(2,5-dihydropyrrol-1-yl)hexoxy]phenyl]-4-fluoro-N-methyl-benzenesulfonamide CAS Name: N-[4-[6-(2,5-dihydropyrrol-1-yl)hexoxy]phenyl]-4-fluoro-N-methylbenzenesulfonamide IUPAC Name: N-[4-[6-(2,5-dihydropyrrol-1-yl)hexoxy]phenyl]-4-fluoro-N-methylbenzenesulfonamide Traditional Name: 4-fluoro-N-methyl-N-[4-[6-(3-pyrrolin-1-yl)hexoxy]phenyl]benzenesulfonamide Formula: C23H29FN2O3S MolecularWeight: 432.551363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OCCCCCCN2CC=CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(C1=CC=C(C=C1)OCCCCCCN2CC=CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H29FN2O3S/c1-25(30(27,28)23-14-8-20(24)9-15-23)21-10-12-22(13-11-21)29-19-7-3-2-4-16-26-17-5-6-18-26/h5-6,8-15H,2-4,7,16-19H2,1H3