3-(2-tert-butyl-5-methyl-4-sulfamoyl-phenoxy)propanoic acid

Systemtic Name: 3-(2-tert-butyl-5-methyl-4-sulfamoyl-phenoxy)propanoic acid Openeye Name: 3-(2-tert-butyl-5-methyl-4-sulfamoyl-phenoxy)propanoic acid CAS Name: 3-(2-tert-butyl-5-methyl-4-sulfamoylphenoxy)propanoic acid IUPAC Name: 3-(2-tert-butyl-5-methyl-4-sulfamoylphenoxy)propanoic acid Traditional Name: 3-(2-tert-butyl-5-methyl-4-sulfamoyl-phenoxy)propionic acid Formula: C14H21NO5S MolecularWeight: 315.38524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)N)C(C)(C)C)OCCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)N)C(C)(C)C)OCCC(=O)O

InChI

InChI=1S/C14H21NO5S/c1-9-7-11(20-6-5-13(16)17)10(14(2,3)4)8-12(9)21(15,18)19/h7-8H,5-6H2,1-4H3,(H,16,17)(H2,15,18,19)