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

Systemtic Name: 4-methyl-N-[(2S)-3-morpholin-4-ium-4-yl-2-oxidanyl-propyl]-N-phenyl-benzenesulfonamide Openeye Name: N-[(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propyl]-4-methyl-N-phenyl-benzenesulfonamide CAS Name: N-[(2S)-2-hydroxy-3-(4-morpholin-4-iumyl)propyl]-4-methyl-N-phenylbenzenesulfonamide IUPAC Name: N-[(2S)-2-hydroxy-3-morpholin-4-ium-4-ylpropyl]-4-methyl-N-phenylbenzenesulfonamide Traditional Name: N-[(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propyl]-4-methyl-N-phenyl-benzenesulfonamide Formula: C20H27N2O4S+ MolecularWeight: 391.50438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(C[NH+]2CCOCC2)O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C[C@H](C[NH+]2CCOCC2)O)C3=CC=CC=C3

InChI

InChI=1S/C20H26N2O4S/c1-17-7-9-20(10-8-17)27(24,25)22(18-5-3-2-4-6-18)16-19(23)15-21-11-13-26-14-12-21/h2-10,19,23H,11-16H2,1H3/p+1/t19-/m0/s1