N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-2-phenyl-benzenesulfonamide

Systemtic Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-2-phenyl-benzenesulfonamide Openeye Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-2-phenyl-benzenesulfonamide CAS Name: N-[(2R)-3-methyl-2-(4-morpholin-4-iumyl)butyl]-2-phenylbenzenesulfonamide IUPAC Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-ylbutyl]-2-phenylbenzenesulfonamide Traditional Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-2-phenyl-benzenesulfonamide Formula: C21H29N2O3S+ MolecularWeight: 389.53156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNS(=O)(=O)C1=CC=CC=C1C2=CC=CC=C2)[NH+]3CCOCC3

Isomeric SMILES

CC(C)[C@H](CNS(=O)(=O)C1=CC=CC=C1C2=CC=CC=C2)[NH+]3CCOCC3

InChI

InChI=1S/C21H28N2O3S/c1-17(2)20(23-12-14-26-15-13-23)16-22-27(24,25)21-11-7-6-10-19(21)18-8-4-3-5-9-18/h3-11,17,20,22H,12-16H2,1-2H3/p+1/t20-/m0/s1