(2-oxidanylidene-2-thiophen-2-yl-ethyl) 5-bromanylpyridine-3-carboxylate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 5-bromanylpyridine-3-carboxylate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C12H8BrNO3S MolecularWeight: 326.16582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)COC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

C1=CSC(=C1)C(=O)COC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C12H8BrNO3S/c13-9-4-8(5-14-6-9)12(16)17-7-10(15)11-2-1-3-18-11/h1-6H,7H2