5-[2-[4-(naphthalen-2-ylcarbonylamino)phenyl]sulfanylethanoylamino]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[2-[4-(naphthalen-2-ylcarbonylamino)phenyl]sulfanylethanoylamino]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-[[2-[4-(naphthalene-2-carbonylamino)phenyl]sulfanylacetyl]amino]benzoic acid CAS Name: 2-hydroxy-5-[[2-[[4-[[2-naphthalenyl(oxo)methyl]amino]phenyl]thio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 2-hydroxy-5-[[2-[4-(naphthalene-2-carbonylamino)phenyl]sulfanylacetyl]amino]benzoic acid Traditional Name: 2-hydroxy-5-[[2-[[4-(2-naphthoylamino)phenyl]thio]acetyl]amino]benzoic acid Formula: C26H20N2O5S MolecularWeight: 472.5124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)NC3=CC=C(C=C3)SCC(=O)NC4=CC(=C(C=C4)O)C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)NC3=CC=C(C=C3)SCC(=O)NC4=CC(=C(C=C4)O)C(=O)O

InChI

InChI=1S/C26H20N2O5S/c29-23-12-9-20(14-22(23)26(32)33)27-24(30)15-34-21-10-7-19(8-11-21)28-25(31)18-6-5-16-3-1-2-4-17(16)13-18/h1-14,29H,15H2,(H,27,30)(H,28,31)(H,32,33)