(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]azanium

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]azanium Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl-methyl-[(1R)-1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl]ammonium CAS Name: (3-fluoro-4-methoxyphenyl)methyl-methyl-[(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl]ammonium IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl-methyl-[(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl]azanium Traditional Name: (3-fluoro-4-methoxy-benzyl)-[(1R)-2-keto-1-methyl-2-(4-sulfamoylanilino)ethyl]-methyl-ammonium Formula: C18H23FN3O4S+ MolecularWeight: 396.456323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)[NH+](C)CC2=CC(=C(C=C2)OC)F

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)[NH+](C)CC2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C18H22FN3O4S/c1-12(22(2)11-13-4-9-17(26-3)16(19)10-13)18(23)21-14-5-7-15(8-6-14)27(20,24)25/h4-10,12H,11H2,1-3H3,(H,21,23)(H2,20,24,25)/p+1/t12-/m1/s1