5-(2,3-dimethyl-4-sulfamoyl-phenoxy)pentanoic acid

Systemtic Name: 5-(2,3-dimethyl-4-sulfamoyl-phenoxy)pentanoic acid Openeye Name: 5-(2,3-dimethyl-4-sulfamoyl-phenoxy)pentanoic acid CAS Name: 5-(2,3-dimethyl-4-sulfamoylphenoxy)pentanoic acid IUPAC Name: 5-(2,3-dimethyl-4-sulfamoylphenoxy)pentanoic acid Traditional Name: 5-(2,3-dimethyl-4-sulfamoyl-phenoxy)valeric acid Formula: C13H19NO5S MolecularWeight: 301.35866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)S(=O)(=O)N)OCCCCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1C)S(=O)(=O)N)OCCCCC(=O)O

InChI

InChI=1S/C13H19NO5S/c1-9-10(2)12(20(14,17)18)7-6-11(9)19-8-4-3-5-13(15)16/h6-7H,3-5,8H2,1-2H3,(H,15,16)(H2,14,17,18)