3-[(3-oxidanylidene-1-phenyl-3-propan-2-yloxy-propyl)sulfamoyl]benzoic acid

Systemtic Name: 3-[(3-oxidanylidene-1-phenyl-3-propan-2-yloxy-propyl)sulfamoyl]benzoic acid Openeye Name: 3-[(3-isopropoxy-3-oxo-1-phenyl-propyl)sulfamoyl]benzoic acid CAS Name: 3-[(3-oxo-1-phenyl-3-propan-2-yloxypropyl)sulfamoyl]benzoic acid IUPAC Name: 3-[(3-oxo-1-phenyl-3-propan-2-yloxypropyl)sulfamoyl]benzoic acid Traditional Name: 3-[(3-isopropoxy-3-keto-1-phenyl-propyl)sulfamoyl]benzoic acid Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO6S/c1-13(2)26-18(21)12-17(14-7-4-3-5-8-14)20-27(24,25)16-10-6-9-15(11-16)19(22)23/h3-11,13,17,20H,12H2,1-2H3,(H,22,23)