2-oxidanyl-4-(2-propan-2-ylsulfanylethanoylamino)benzoic acid

Systemtic Name: 2-oxidanyl-4-(2-propan-2-ylsulfanylethanoylamino)benzoic acid Openeye Name: 2-hydroxy-4-[(2-isopropylsulfanylacetyl)amino]benzoic acid CAS Name: 2-hydroxy-4-[[1-oxo-2-(propan-2-ylthio)ethyl]amino]benzoic acid IUPAC Name: 2-hydroxy-4-[(2-propan-2-ylsulfanylacetyl)amino]benzoic acid Traditional Name: 2-hydroxy-4-[[2-(isopropylthio)acetyl]amino]benzoic acid Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO4S/c1-7(2)18-6-11(15)13-8-3-4-9(12(16)17)10(14)5-8/h3-5,7,14H,6H2,1-2H3,(H,13,15)(H,16,17)