ethyl 5-[(5-ethoxycarbonyl-3-nitro-thiophen-2-yl)disulfanyl]-4-nitro-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[(5-ethoxycarbonyl-3-nitro-thiophen-2-yl)disulfanyl]-4-nitro-thiophene-2-carboxylate Openeye Name: ethyl 5-[(5-ethoxycarbonyl-3-nitro-2-thienyl)disulfanyl]-4-nitro-thiophene-2-carboxylate CAS Name: 5-[(5-ethoxycarbonyl-3-nitro-2-thiophenyl)disulfanyl]-4-nitro-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(5-ethoxycarbonyl-3-nitrothiophen-2-yl)disulfanyl]-4-nitrothiophene-2-carboxylate Traditional Name: 5-[(5-carbethoxy-3-nitro-2-thienyl)disulfanyl]-4-nitro-thiophene-2-carboxylic acid ethyl ester Formula: C14H12N2O8S4 MolecularWeight: 464.51368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(S1)SSC2=C(C=C(S2)C(=O)OCC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=C(S1)SSC2=C(C=C(S2)C(=O)OCC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O8S4/c1-3-23-11(17)9-5-7(15(19)20)13(25-9)27-28-14-8(16(21)22)6-10(26-14)12(18)24-4-2/h5-6H,3-4H2,1-2H3