N-[(2S)-3-(2,6-dimethylphenoxy)-2-oxidanyl-propyl]-2-morpholin-4-ylcarbonyl-benzenesulfonamide

Systemtic Name: N-[(2S)-3-(2,6-dimethylphenoxy)-2-oxidanyl-propyl]-2-morpholin-4-ylcarbonyl-benzenesulfonamide Openeye Name: N-[(2S)-3-(2,6-dimethylphenoxy)-2-hydroxy-propyl]-2-(morpholine-4-carbonyl)benzenesulfonamide CAS Name: N-[(2S)-3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-2-[4-morpholinyl(oxo)methyl]benzenesulfonamide IUPAC Name: N-[(2S)-3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-2-(morpholine-4-carbonyl)benzenesulfonamide Traditional Name: N-[(2S)-3-(2,6-dimethylphenoxy)-2-hydroxy-propyl]-2-(morpholine-4-carbonyl)benzenesulfonamide Formula: C22H28N2O6S MolecularWeight: 448.53252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(CNS(=O)(=O)C2=CC=CC=C2C(=O)N3CCOCC3)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC[C@H](CNS(=O)(=O)C2=CC=CC=C2C(=O)N3CCOCC3)O

InChI

InChI=1S/C22H28N2O6S/c1-16-6-5-7-17(2)21(16)30-15-18(25)14-23-31(27,28)20-9-4-3-8-19(20)22(26)24-10-12-29-13-11-24/h3-9,18,23,25H,10-15H2,1-2H3/t18-/m0/s1