[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 4,5-bis(bromanyl)thiophene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 4,5-bis(bromanyl)thiophene-2-carboxylate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 4,5-dibromothiophene-2-carboxylate CAS Name: 4,5-dibromo-2-thiophenecarboxylic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 4,5-dibromothiophene-2-carboxylate Traditional Name: 4,5-dibromothiophene-2-carboxylic acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C16H14Br2O3S MolecularWeight: 446.15356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)C2=CC(=C(S2)Br)Br)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)C2=CC(=C(S2)Br)Br)C)C

InChI

InChI=1S/C16H14Br2O3S/c1-8-4-10(3)11(5-9(8)2)13(19)7-21-16(20)14-6-12(17)15(18)22-14/h4-6H,7H2,1-3H3