N-(4-methoxyphenyl)-4-methyl-N-[(2S)-2-oxidanyl-3-piperidin-1-yl-propyl]benzenesulfonamide

Systemtic Name: N-(4-methoxyphenyl)-4-methyl-N-[(2S)-2-oxidanyl-3-piperidin-1-yl-propyl]benzenesulfonamide Openeye Name: N-[(2S)-2-hydroxy-3-(1-piperidyl)propyl]-N-(4-methoxyphenyl)-4-methyl-benzenesulfonamide CAS Name: N-[(2S)-2-hydroxy-3-(1-piperidinyl)propyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamide IUPAC Name: N-[(2S)-2-hydroxy-3-piperidin-1-ylpropyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamide Traditional Name: N-[(2S)-2-hydroxy-3-piperidino-propyl]-N-(4-methoxyphenyl)-4-methyl-benzenesulfonamide Formula: C22H30N2O4S MolecularWeight: 418.5496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(CN2CCCCC2)O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C[C@H](CN2CCCCC2)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H30N2O4S/c1-18-6-12-22(13-7-18)29(26,27)24(19-8-10-21(28-2)11-9-19)17-20(25)16-23-14-4-3-5-15-23/h6-13,20,25H,3-5,14-17H2,1-2H3/t20-/m0/s1