2-(4-bromanylphenoxy)ethyl-methyl-[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl]azanium

Systemtic Name: 2-(4-bromanylphenoxy)ethyl-methyl-[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl]azanium Openeye Name: 2-(4-bromophenoxy)ethyl-methyl-[2-oxo-2-(3-sulfamoylanilino)ethyl]ammonium CAS Name: 2-(4-bromophenoxy)ethyl-methyl-[2-oxo-2-(3-sulfamoylanilino)ethyl]ammonium IUPAC Name: 2-(4-bromophenoxy)ethyl-methyl-[2-oxo-2-(3-sulfamoylanilino)ethyl]azanium Traditional Name: 2-(4-bromophenoxy)ethyl-[2-keto-2-(3-sulfamoylanilino)ethyl]-methyl-ammonium Formula: C17H21BrN3O4S+ MolecularWeight: 443.33534

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=C(C=C1)Br)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N

Isomeric SMILES

C[NH+](CCOC1=CC=C(C=C1)Br)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N

InChI

InChI=1S/C17H20BrN3O4S/c1-21(9-10-25-15-7-5-13(18)6-8-15)12-17(22)20-14-3-2-4-16(11-14)26(19,23)24/h2-8,11H,9-10,12H2,1H3,(H,20,22)(H2,19,23,24)/p+1