2-[[3-[(3-bromanyl-4-methoxy-phenyl)sulfamoyl]phenyl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3-[(3-bromanyl-4-methoxy-phenyl)sulfamoyl]phenyl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-[(3-bromo-4-methoxy-phenyl)sulfamoyl]benzoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-[(3-bromo-4-methoxyphenyl)sulfamoyl]phenyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-[(3-bromo-4-methoxyphenyl)sulfamoyl]benzoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[3-[(3-bromo-4-methoxy-phenyl)sulfamoyl]benzoyl]amino]ethyl-dimethyl-ammonium Formula: C18H23BrN3O4S+ MolecularWeight: 457.36192

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC(=C(C=C2)OC)Br

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C18H22BrN3O4S/c1-22(2)10-9-20-18(23)13-5-4-6-15(11-13)27(24,25)21-14-7-8-17(26-3)16(19)12-14/h4-8,11-12,21H,9-10H2,1-3H3,(H,20,23)/p+1