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

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxylate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 5-isopropyl-3-methyl-isoxazole-4-carboxylate CAS Name: 3-methyl-5-propan-2-yl-4-isoxazolecarboxylic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxylate Traditional Name: 5-isopropyl-3-methyl-isoxazole-4-carboxylic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C14H14BrNO4S MolecularWeight: 372.23426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)OCC(=O)C2=CC=C(S2)Br)C(C)C

Isomeric SMILES

CC1=NOC(=C1C(=O)OCC(=O)C2=CC=C(S2)Br)C(C)C

InChI

InChI=1S/C14H14BrNO4S/c1-7(2)13-12(8(3)16-20-13)14(18)19-6-9(17)10-4-5-11(15)21-10/h4-5,7H,6H2,1-3H3