ethyl 2-[(5-bromanylthiophen-2-yl)carbonylamino]-5-nitro-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(5-bromanylthiophen-2-yl)carbonylamino]-5-nitro-thiophene-3-carboxylate Openeye Name: ethyl 2-[(5-bromothiophene-2-carbonyl)amino]-5-nitro-thiophene-3-carboxylate CAS Name: 2-[[(5-bromo-2-thiophenyl)-oxomethyl]amino]-5-nitro-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-bromothiophene-2-carbonyl)amino]-5-nitrothiophene-3-carboxylate Traditional Name: 2-[(5-bromothiophene-2-carbonyl)amino]-5-nitro-thiophene-3-carboxylic acid ethyl ester Formula: C12H9BrN2O5S2 MolecularWeight: 405.24426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)[N+](=O)[O-])NC(=O)C2=CC=C(S2)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)[N+](=O)[O-])NC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C12H9BrN2O5S2/c1-2-20-12(17)6-5-9(15(18)19)22-11(6)14-10(16)7-3-4-8(13)21-7/h3-5H,2H2,1H3,(H,14,16)