5-[(2,5-diethoxy-4-morpholin-4-yl-phenyl)sulfamoyl]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[(2,5-diethoxy-4-morpholin-4-yl-phenyl)sulfamoyl]-2-fluoranyl-benzoic acid Openeye Name: 5-[(2,5-diethoxy-4-morpholino-phenyl)sulfamoyl]-2-fluoro-benzoic acid CAS Name: 5-[[2,5-diethoxy-4-(4-morpholinyl)phenyl]sulfamoyl]-2-fluorobenzoic acid IUPAC Name: 5-[(2,5-diethoxy-4-morpholin-4-ylphenyl)sulfamoyl]-2-fluorobenzoic acid Traditional Name: 5-[(2,5-diethoxy-4-morpholino-phenyl)sulfamoyl]-2-fluoro-benzoic acid Formula: C21H25FN2O7S MolecularWeight: 468.495803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NS(=O)(=O)C3=CC(=C(C=C3)F)C(=O)O

Isomeric SMILES

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NS(=O)(=O)C3=CC(=C(C=C3)F)C(=O)O

InChI

InChI=1S/C21H25FN2O7S/c1-3-30-19-13-18(24-7-9-29-10-8-24)20(31-4-2)12-17(19)23-32(27,28)14-5-6-16(22)15(11-14)21(25)26/h5-6,11-13,23H,3-4,7-10H2,1-2H3,(H,25,26)