5-oxidanyl-2-[2-(phenylmethylsulfanyl)ethanoylamino]benzoate

Systemtic Name: 5-oxidanyl-2-[2-(phenylmethylsulfanyl)ethanoylamino]benzoate Openeye Name: 2-[(2-benzylsulfanylacetyl)amino]-5-hydroxy-benzoate CAS Name: 5-hydroxy-2-[[1-oxo-2-(phenylmethylthio)ethyl]amino]benzoate IUPAC Name: 2-[(2-benzylsulfanylacetyl)amino]-5-hydroxybenzoate Traditional Name: 2-[[2-(benzylthio)acetyl]amino]-5-hydroxy-benzoate Formula: C16H14NO4S- MolecularWeight: 316.35166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(=O)NC2=C(C=C(C=C2)O)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSCC(=O)NC2=C(C=C(C=C2)O)C(=O)[O-]

InChI

InChI=1S/C16H15NO4S/c18-12-6-7-14(13(8-12)16(20)21)17-15(19)10-22-9-11-4-2-1-3-5-11/h1-8,18H,9-10H2,(H,17,19)(H,20,21)/p-1