[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl] 4-bromanylbenzoate

Systemtic Name: [2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl] 4-bromanylbenzoate Openeye Name: [2-(2,5-dimethyl-3-thienyl)-2-oxo-ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-(2,5-dimethyl-3-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylthiophen-3-yl)-2-oxoethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(2,5-dimethyl-3-thienyl)-2-keto-ethyl] ester Formula: C15H13BrO3S MolecularWeight: 353.23092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)COC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)COC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C15H13BrO3S/c1-9-7-13(10(2)20-9)14(17)8-19-15(18)11-3-5-12(16)6-4-11/h3-7H,8H2,1-2H3