4-(2-ethylsulfinylethanoylamino)benzoic acid

Systemtic Name: 4-(2-ethylsulfinylethanoylamino)benzoic acid Openeye Name: 4-[(2-ethylsulfinylacetyl)amino]benzoic acid CAS Name: 4-[(2-ethylsulfinyl-1-oxoethyl)amino]benzoic acid IUPAC Name: 4-[(2-ethylsulfinylacetyl)amino]benzoic acid Traditional Name: 4-[(2-ethylsulfinylacetyl)amino]benzoic acid Formula: C11H13NO4S MolecularWeight: 255.29022

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)CC(=O)NC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCS(=O)CC(=O)NC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C11H13NO4S/c1-2-17(16)7-10(13)12-9-5-3-8(4-6-9)11(14)15/h3-6H,2,7H2,1H3,(H,12,13)(H,14,15)