2-(2-nitrophenyl)sulfanyl-4-oxidanyl-benzoic acid

Systemtic Name: 2-(2-nitrophenyl)sulfanyl-4-oxidanyl-benzoic acid Openeye Name: 4-hydroxy-2-(2-nitrophenyl)sulfanyl-benzoic acid CAS Name: 4-hydroxy-2-[(2-nitrophenyl)thio]benzoic acid IUPAC Name: 4-hydroxy-2-(2-nitrophenyl)sulfanylbenzoic acid Traditional Name: 4-hydroxy-2-[(2-nitrophenyl)thio]benzoic acid Formula: C13H9NO5S MolecularWeight: 291.27926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])SC2=C(C=CC(=C2)O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])SC2=C(C=CC(=C2)O)C(=O)O

InChI

InChI=1S/C13H9NO5S/c15-8-5-6-9(13(16)17)12(7-8)20-11-4-2-1-3-10(11)14(18)19/h1-7,15H,(H,16,17)