[1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 4-(3-bromanylphenoxy)butanoate

Systemtic Name: [1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 4-(3-bromanylphenoxy)butanoate Openeye Name: [1-methyl-2-oxo-2-(3-sulfamoylanilino)ethyl] 4-(3-bromophenoxy)butanoate CAS Name: 4-(3-bromophenoxy)butanoic acid [1-oxo-1-(3-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(3-sulfamoylanilino)propan-2-yl] 4-(3-bromophenoxy)butanoate Traditional Name: 4-(3-bromophenoxy)butyric acid [2-keto-1-methyl-2-(3-sulfamoylanilino)ethyl] ester Formula: C19H21BrN2O6S MolecularWeight: 485.34884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)OC(=O)CCCOC2=CC(=CC=C2)Br

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)OC(=O)CCCOC2=CC(=CC=C2)Br

InChI

InChI=1S/C19H21BrN2O6S/c1-13(19(24)22-15-6-3-8-17(12-15)29(21,25)26)28-18(23)9-4-10-27-16-7-2-5-14(20)11-16/h2-3,5-8,11-13H,4,9-10H2,1H3,(H,22,24)(H2,21,25,26)