methyl 4-(5-bromanyl-6-chloranyl-pyridin-3-yl)sulfonyl-5-nitro-thiophene-2-carboxylate

Systemtic Name: methyl 4-(5-bromanyl-6-chloranyl-pyridin-3-yl)sulfonyl-5-nitro-thiophene-2-carboxylate Openeye Name: methyl 4-[(5-bromo-6-chloro-3-pyridyl)sulfonyl]-5-nitro-thiophene-2-carboxylate CAS Name: 4-[(5-bromo-6-chloro-3-pyridinyl)sulfonyl]-5-nitro-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(5-bromo-6-chloropyridin-3-yl)sulfonyl-5-nitrothiophene-2-carboxylate Traditional Name: 4-[(5-bromo-6-chloro-3-pyridyl)sulfonyl]-5-nitro-thiophene-2-carboxylic acid methyl ester Formula: C11H6BrClN2O6S2 MolecularWeight: 441.66214

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)[N+](=O)[O-])S(=O)(=O)C2=CC(=C(N=C2)Cl)Br

Isomeric SMILES

COC(=O)C1=CC(=C(S1)[N+](=O)[O-])S(=O)(=O)C2=CC(=C(N=C2)Cl)Br

InChI

InChI=1S/C11H6BrClN2O6S2/c1-21-11(16)7-3-8(10(22-7)15(17)18)23(19,20)5-2-6(12)9(13)14-4-5/h2-4H,1H3