[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 3,5-dimethyl-1,2-oxazole-4-carboxylate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 3,5-dimethyl-1,2-oxazole-4-carboxylate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 3,5-dimethylisoxazole-4-carboxylate CAS Name: 3,5-dimethyl-4-isoxazolecarboxylic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 3,5-dimethyl-1,2-oxazole-4-carboxylate Traditional Name: 3,5-dimethylisoxazole-4-carboxylic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C12H10BrNO4S MolecularWeight: 344.1811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)OCC(=O)C2=CC=C(S2)Br

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)OCC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C12H10BrNO4S/c1-6-11(7(2)18-14-6)12(16)17-5-8(15)9-3-4-10(13)19-9/h3-4H,5H2,1-2H3