[2-[[3,5-bis(chloranyl)pyridin-2-yl]amino]-2-oxidanylidene-ethyl] 5-nitrothiophene-2-carboxylate

Systemtic Name: [2-[[3,5-bis(chloranyl)pyridin-2-yl]amino]-2-oxidanylidene-ethyl] 5-nitrothiophene-2-carboxylate Openeye Name: [2-[(3,5-dichloro-2-pyridyl)amino]-2-oxo-ethyl] 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid [2-[(3,5-dichloro-2-pyridinyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3,5-dichloropyridin-2-yl)amino]-2-oxoethyl] 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid [2-[(3,5-dichloro-2-pyridyl)amino]-2-keto-ethyl] ester Formula: C12H7Cl2N3O5S MolecularWeight: 376.17208

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=C(C=C(C=N2)Cl)Cl

Isomeric SMILES

C1=C(SC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=C(C=C(C=N2)Cl)Cl

InChI

InChI=1S/C12H7Cl2N3O5S/c13-6-3-7(14)11(15-4-6)16-9(18)5-22-12(19)8-1-2-10(23-8)17(20)21/h1-4H,5H2,(H,15,16,18)