2-[(3-chloranyl-4-fluoranyl-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid Openeye Name: 2-[(3-chloro-4-fluoro-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid CAS Name: 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid IUPAC Name: 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid Traditional Name: 2-[(3-chloro-4-fluoro-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid Formula: C17H17ClFNO7S MolecularWeight: 433.835783

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C(=C1)NS(=O)(=O)C2=CC(=C(C=C2)F)Cl)C(=O)O)OC

Isomeric SMILES

COCCOC1=C(C=C(C(=C1)NS(=O)(=O)C2=CC(=C(C=C2)F)Cl)C(=O)O)OC

InChI

InChI=1S/C17H17ClFNO7S/c1-25-5-6-27-16-9-14(11(17(21)22)8-15(16)26-2)20-28(23,24)10-3-4-13(19)12(18)7-10/h3-4,7-9,20H,5-6H2,1-2H3,(H,21,22)