[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 6-chloranylpyridine-3-carboxylate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 6-chloranylpyridine-3-carboxylate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 6-chloropyridine-3-carboxylate CAS Name: 6-chloro-3-pyridinecarboxylic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 6-chloropyridine-3-carboxylate Traditional Name: 6-chloronicotinic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C12H7BrClNO3S MolecularWeight: 360.61088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1C(=O)OCC(=O)C2=CC=C(S2)Br)Cl

Isomeric SMILES

C1=CC(=NC=C1C(=O)OCC(=O)C2=CC=C(S2)Br)Cl

InChI

InChI=1S/C12H7BrClNO3S/c13-10-3-2-9(19-10)8(16)6-18-12(17)7-1-4-11(14)15-5-7/h1-5H,6H2