2-(2,4-dinitrophenyl)sulfanylbenzoate

Systemtic Name: 2-(2,4-dinitrophenyl)sulfanylbenzoate Openeye Name: 2-(2,4-dinitrophenyl)sulfanylbenzoate CAS Name: 2-[(2,4-dinitrophenyl)thio]benzoate IUPAC Name: 2-(2,4-dinitrophenyl)sulfanylbenzoate Traditional Name: 2-[(2,4-dinitrophenyl)thio]benzoate Formula: C13H7N2O6S- MolecularWeight: 319.26948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8N2O6S/c16-13(17)9-3-1-2-4-11(9)22-12-6-5-8(14(18)19)7-10(12)15(20)21/h1-7H,(H,16,17)/p-1