4-(2-sulfanylethanoylamino)benzoic acid

Systemtic Name: 4-(2-sulfanylethanoylamino)benzoic acid Openeye Name: 4-[(2-sulfanylacetyl)amino]benzoic acid CAS Name: 4-[(2-mercapto-1-oxoethyl)amino]benzoic acid IUPAC Name: 4-[(2-sulfanylacetyl)amino]benzoic acid Traditional Name: 4-[(2-mercaptoacetyl)amino]benzoic acid Formula: C9H9NO3S MolecularWeight: 211.23766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO3S/c11-8(5-14)10-7-3-1-6(2-4-7)9(12)13/h1-4,14H,5H2,(H,10,11)(H,12,13)