5-(2-butylsulfanylethanoylamino)-2-oxidanyl-benzoic acid

Systemtic Name: 5-(2-butylsulfanylethanoylamino)-2-oxidanyl-benzoic acid Openeye Name: 5-[(2-butylsulfanylacetyl)amino]-2-hydroxy-benzoic acid CAS Name: 5-[[2-(butylthio)-1-oxoethyl]amino]-2-hydroxybenzoic acid IUPAC Name: 5-[(2-butylsulfanylacetyl)amino]-2-hydroxybenzoic acid Traditional Name: 5-[[2-(butylthio)acetyl]amino]-2-hydroxy-benzoic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO4S/c1-2-3-6-19-8-12(16)14-9-4-5-11(15)10(7-9)13(17)18/h4-5,7,15H,2-3,6,8H2,1H3,(H,14,16)(H,17,18)