2-(4-nitrophenyl)sulfanylbenzoate

Systemtic Name: 2-(4-nitrophenyl)sulfanylbenzoate Openeye Name: 2-(4-nitrophenyl)sulfanylbenzoate CAS Name: 2-[(4-nitrophenyl)thio]benzoate IUPAC Name: 2-(4-nitrophenyl)sulfanylbenzoate Traditional Name: 2-[(4-nitrophenyl)thio]benzoate Formula: C13H8NO4S- MolecularWeight: 274.27192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9NO4S/c15-13(16)11-3-1-2-4-12(11)19-10-7-5-9(6-8-10)14(17)18/h1-8H,(H,15,16)/p-1