5-(2,5-dimethyl-4-sulfamoyl-phenoxy)pentanoic acid

Systemtic Name: 5-(2,5-dimethyl-4-sulfamoyl-phenoxy)pentanoic acid Openeye Name: 5-(2,5-dimethyl-4-sulfamoyl-phenoxy)pentanoic acid CAS Name: 5-(2,5-dimethyl-4-sulfamoylphenoxy)pentanoic acid IUPAC Name: 5-(2,5-dimethyl-4-sulfamoylphenoxy)pentanoic acid Traditional Name: 5-(2,5-dimethyl-4-sulfamoyl-phenoxy)valeric acid Formula: C13H19NO5S MolecularWeight: 301.35866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO5S/c1-9-8-12(20(14,17)18)10(2)7-11(9)19-6-4-3-5-13(15)16/h7-8H,3-6H2,1-2H3,(H,15,16)(H2,14,17,18)