5-methoxy-4-(2-methoxyethoxy)-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]benzoic acid

Systemtic Name: 5-methoxy-4-(2-methoxyethoxy)-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]benzoic acid Openeye Name: 5-methoxy-4-(2-methoxyethoxy)-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]benzoic acid CAS Name: 5-methoxy-4-(2-methoxyethoxy)-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]benzoic acid IUPAC Name: 5-methoxy-4-(2-methoxyethoxy)-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]benzoic acid Traditional Name: 5-methoxy-4-(2-methoxyethoxy)-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]benzoic acid Formula: C18H18F3NO7S MolecularWeight: 449.39823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18F3NO7S/c1-27-7-8-29-16-10-14(13(17(23)24)9-15(16)28-2)22-30(25,26)12-5-3-11(4-6-12)18(19,20)21/h3-6,9-10,22H,7-8H2,1-2H3,(H,23,24)