3-(2-phenylsulfanylethanoylamino)benzoic acid

Systemtic Name: 3-(2-phenylsulfanylethanoylamino)benzoic acid Openeye Name: 3-[(2-phenylsulfanylacetyl)amino]benzoic acid CAS Name: 3-[[1-oxo-2-(phenylthio)ethyl]amino]benzoic acid IUPAC Name: 3-[(2-phenylsulfanylacetyl)amino]benzoic acid Traditional Name: 3-[[2-(phenylthio)acetyl]amino]benzoic acid Formula: C15H13NO3S MolecularWeight: 287.33362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C15H13NO3S/c17-14(10-20-13-7-2-1-3-8-13)16-12-6-4-5-11(9-12)15(18)19/h1-9H,10H2,(H,16,17)(H,18,19)