ethyl 4-chloranyl-5-[(2-chloranyl-5-ethoxycarbonyl-4-nitro-phenyl)disulfanyl]-2-nitro-benzoate

Systemtic Name: ethyl 4-chloranyl-5-[(2-chloranyl-5-ethoxycarbonyl-4-nitro-phenyl)disulfanyl]-2-nitro-benzoate Openeye Name: ethyl 4-chloro-5-[(2-chloro-5-ethoxycarbonyl-4-nitro-phenyl)disulfanyl]-2-nitro-benzoate CAS Name: 4-chloro-5-[(2-chloro-5-ethoxycarbonyl-4-nitrophenyl)disulfanyl]-2-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 4-chloro-5-[(2-chloro-5-ethoxycarbonyl-4-nitrophenyl)disulfanyl]-2-nitrobenzoate Traditional Name: 5-[(5-carbethoxy-2-chloro-4-nitro-phenyl)disulfanyl]-4-chloro-2-nitro-benzoic acid ethyl ester Formula: C18H14Cl2N2O8S2 MolecularWeight: 521.34836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1[N+](=O)[O-])Cl)SSC2=C(C=C(C(=C2)C(=O)OCC)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1[N+](=O)[O-])Cl)SSC2=C(C=C(C(=C2)C(=O)OCC)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H14Cl2N2O8S2/c1-3-29-17(23)9-5-15(11(19)7-13(9)21(25)26)31-32-16-6-10(18(24)30-4-2)14(22(27)28)8-12(16)20/h5-8H,3-4H2,1-2H3