N-(2-methoxyphenyl)-N-[(2S)-3-morpholin-4-ium-4-yl-2-oxidanyl-propyl]benzenesulfonamide

Systemtic Name: N-(2-methoxyphenyl)-N-[(2S)-3-morpholin-4-ium-4-yl-2-oxidanyl-propyl]benzenesulfonamide Openeye Name: N-[(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propyl]-N-(2-methoxyphenyl)benzenesulfonamide CAS Name: N-[(2S)-2-hydroxy-3-(4-morpholin-4-iumyl)propyl]-N-(2-methoxyphenyl)benzenesulfonamide IUPAC Name: N-[(2S)-2-hydroxy-3-morpholin-4-ium-4-ylpropyl]-N-(2-methoxyphenyl)benzenesulfonamide Traditional Name: N-[(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propyl]-N-(2-methoxyphenyl)benzenesulfonamide Formula: C20H27N2O5S+ MolecularWeight: 407.50378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N(CC(C[NH+]2CCOCC2)O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1N(C[C@H](C[NH+]2CCOCC2)O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H26N2O5S/c1-26-20-10-6-5-9-19(20)22(28(24,25)18-7-3-2-4-8-18)16-17(23)15-21-11-13-27-14-12-21/h2-10,17,23H,11-16H2,1H3/p+1/t17-/m0/s1