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

Systemtic Name: 4-methoxy-3-[(3-oxidanylidene-1-phenyl-3-propan-2-yloxy-propyl)sulfamoyl]benzoic acid Openeye Name: 3-[(3-isopropoxy-3-oxo-1-phenyl-propyl)sulfamoyl]-4-methoxy-benzoic acid CAS Name: 4-methoxy-3-[(3-oxo-1-phenyl-3-propan-2-yloxypropyl)sulfamoyl]benzoic acid IUPAC Name: 4-methoxy-3-[(3-oxo-1-phenyl-3-propan-2-yloxypropyl)sulfamoyl]benzoic acid Traditional Name: 3-[(3-isopropoxy-3-keto-1-phenyl-propyl)sulfamoyl]-4-methoxy-benzoic acid Formula: C20H23NO7S MolecularWeight: 421.46412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO7S/c1-13(2)28-19(22)12-16(14-7-5-4-6-8-14)21-29(25,26)18-11-15(20(23)24)9-10-17(18)27-3/h4-11,13,16,21H,12H2,1-3H3,(H,23,24)