4-oxidanyl-3-[2-(2-sulfanylethanoylamino)ethanoylamino]benzoic acid

Systemtic Name: 4-oxidanyl-3-[2-(2-sulfanylethanoylamino)ethanoylamino]benzoic acid Openeye Name: 4-hydroxy-3-[[2-[(2-sulfanylacetyl)amino]acetyl]amino]benzoic acid CAS Name: 4-hydroxy-3-[[2-[(2-mercapto-1-oxoethyl)amino]-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-hydroxy-3-[[2-[(2-sulfanylacetyl)amino]acetyl]amino]benzoic acid Traditional Name: 4-hydroxy-3-[[2-[(2-mercaptoacetyl)amino]acetyl]amino]benzoic acid Formula: C11H12N2O5S MolecularWeight: 284.28838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)NC(=O)CNC(=O)CS)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)NC(=O)CNC(=O)CS)O

InChI

InChI=1S/C11H12N2O5S/c14-8-2-1-6(11(17)18)3-7(8)13-9(15)4-12-10(16)5-19/h1-3,14,19H,4-5H2,(H,12,16)(H,13,15)(H,17,18)