5-[(3-carboxylato-4-nitro-phenyl)disulfanyl]-2-nitro-benzoate

Systemtic Name: 5-[(3-carboxylato-4-nitro-phenyl)disulfanyl]-2-nitro-benzoate Openeye Name: 5-[(3-carboxylato-4-nitro-phenyl)disulfanyl]-2-nitro-benzoate CAS Name: 5-[(3-carboxylato-4-nitrophenyl)disulfanyl]-2-nitrobenzoate IUPAC Name: 5-[(3-carboxylato-4-nitrophenyl)disulfanyl]-2-nitrobenzoate Traditional Name: 5-[(3-carboxylato-4-nitro-phenyl)disulfanyl]-2-nitro-benzoate Formula: C14H6N2O8S2-2 MolecularWeight: 394.33604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SSC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)[O-])C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1SSC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)[O-])C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H8N2O8S2/c17-13(18)9-5-7(1-3-11(9)15(21)22)25-26-8-2-4-12(16(23)24)10(6-8)14(19)20/h1-6H,(H,17,18)(H,19,20)/p-2