(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-[3-oxidanylidene-3-[(4-sulfamoylphenyl)amino]propyl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22FN3O4S/c1-22(12-13-3-8-17(26-2)16(19)11-13)10-9-18(23)21-14-4-6-15(7-5-14)27(20,24)25/h3-8,11H,9-10,12H2,1-2H3,(H,21,23)(H2,20,24,25)/p+1