4-[[1-(4-ethoxyphenyl)-3-oxidanyl-3-oxidanylidene-propyl]sulfamoyl]benzoic acid

Systemtic Name: 4-[[1-(4-ethoxyphenyl)-3-oxidanyl-3-oxidanylidene-propyl]sulfamoyl]benzoic acid Openeye Name: 4-[[1-(4-ethoxyphenyl)-3-hydroxy-3-oxo-propyl]sulfamoyl]benzoic acid CAS Name: 4-[[1-(4-ethoxyphenyl)-3-hydroxy-3-oxopropyl]sulfamoyl]benzoic acid IUPAC Name: 4-[[1-(4-ethoxyphenyl)-3-hydroxy-3-oxopropyl]sulfamoyl]benzoic acid Traditional Name: 4-[(3-hydroxy-3-keto-1-p-phenetyl-propyl)sulfamoyl]benzoic acid Formula: C18H19NO7S MolecularWeight: 393.41096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H19NO7S/c1-2-26-14-7-3-12(4-8-14)16(11-17(20)21)19-27(24,25)15-9-5-13(6-10-15)18(22)23/h3-10,16,19H,2,11H2,1H3,(H,20,21)(H,22,23)