2-ethyl-3-(methylsulfonylamino)benzoic acid

Systemtic Name: 2-ethyl-3-(methylsulfonylamino)benzoic acid Openeye Name: 2-ethyl-3-(methanesulfonamido)benzoic acid CAS Name: 2-ethyl-3-(methanesulfonamido)benzoic acid IUPAC Name: 2-ethyl-3-(methanesulfonamido)benzoic acid Traditional Name: 2-ethyl-3-(methanesulfonamido)benzoic acid Formula: C10H13NO4S MolecularWeight: 243.27952

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC=C1NS(=O)(=O)C)C(=O)O

Isomeric SMILES

CCC1=C(C=CC=C1NS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C10H13NO4S/c1-3-7-8(10(12)13)5-4-6-9(7)11-16(2,14)15/h4-6,11H,3H2,1-2H3,(H,12,13)