(4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]azanium

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]azanium Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-[(1R)-1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl]ammonium CAS Name: (4,5-dimethoxy-2-methylphenyl)methyl-methyl-[(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl]ammonium IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl-methyl-[(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl]azanium Traditional Name: (4,5-dimethoxy-2-methyl-benzyl)-[(1R)-2-keto-1-methyl-2-(4-sulfamoylanilino)ethyl]-methyl-ammonium Formula: C20H28N3O5S+ MolecularWeight: 422.51842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH+](C)C(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+](C)[C@H](C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)OC)OC

InChI

InChI=1S/C20H27N3O5S/c1-13-10-18(27-4)19(28-5)11-15(13)12-23(3)14(2)20(24)22-16-6-8-17(9-7-16)29(21,25)26/h6-11,14H,12H2,1-5H3,(H,22,24)(H2,21,25,26)/p+1/t14-/m1/s1