2-methoxy-4,5-dimethyl-N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]benzenesulfonamide

Systemtic Name: 2-methoxy-4,5-dimethyl-N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]benzenesulfonamide Openeye Name: 2-methoxy-4,5-dimethyl-N-[(2R)-2-morpholin-4-ium-4-yl-2-(p-tolyl)ethyl]benzenesulfonamide CAS Name: 2-methoxy-4,5-dimethyl-N-[(2R)-2-(4-methylphenyl)-2-(4-morpholin-4-iumyl)ethyl]benzenesulfonamide IUPAC Name: 2-methoxy-4,5-dimethyl-N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]benzenesulfonamide Traditional Name: 2-methoxy-4,5-dimethyl-N-[(2R)-2-morpholin-4-ium-4-yl-2-(p-tolyl)ethyl]benzenesulfonamide Formula: C22H31N2O4S+ MolecularWeight: 419.55754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNS(=O)(=O)C2=C(C=C(C(=C2)C)C)OC)[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CNS(=O)(=O)C2=C(C=C(C(=C2)C)C)OC)[NH+]3CCOCC3

InChI

InChI=1S/C22H30N2O4S/c1-16-5-7-19(8-6-16)20(24-9-11-28-12-10-24)15-23-29(25,26)22-14-18(3)17(2)13-21(22)27-4/h5-8,13-14,20,23H,9-12,15H2,1-4H3/p+1/t20-/m0/s1