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

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 3-ethyl-5-methyl-isoxazole-4-carboxylate CAS Name: 3-ethyl-5-methyl-4-isoxazolecarboxylic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-ethyl-5-methyl-isoxazole-4-carboxylic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C13H12BrNO4S MolecularWeight: 358.20768

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)OCC(=O)C2=CC=C(S2)Br)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)OCC(=O)C2=CC=C(S2)Br)C

InChI

InChI=1S/C13H12BrNO4S/c1-3-8-12(7(2)19-15-8)13(17)18-6-9(16)10-4-5-11(14)20-10/h4-5H,3,6H2,1-2H3