3,4-dimethoxy-N-[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]benzenesulfonamide

Systemtic Name: 3,4-dimethoxy-N-[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]benzenesulfonamide Openeye Name: 3,4-dimethoxy-N-[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]benzenesulfonamide CAS Name: 3,4-dimethoxy-N-[(2S)-4-methyl-2-(4-morpholin-4-iumyl)pentyl]benzenesulfonamide IUPAC Name: 3,4-dimethoxy-N-[(2S)-4-methyl-2-morpholin-4-ium-4-ylpentyl]benzenesulfonamide Traditional Name: 3,4-dimethoxy-N-[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]benzenesulfonamide Formula: C18H31N2O5S+ MolecularWeight: 387.51414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNS(=O)(=O)C1=CC(=C(C=C1)OC)OC)[NH+]2CCOCC2

Isomeric SMILES

CC(C)C[C@@H](CNS(=O)(=O)C1=CC(=C(C=C1)OC)OC)[NH+]2CCOCC2

InChI

InChI=1S/C18H30N2O5S/c1-14(2)11-15(20-7-9-25-10-8-20)13-19-26(21,22)16-5-6-17(23-3)18(12-16)24-4/h5-6,12,14-15,19H,7-11,13H2,1-4H3/p+1/t15-/m0/s1