[2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] 5-ethanoylthiophene-2-carboxylate

Systemtic Name: [2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] 5-ethanoylthiophene-2-carboxylate Openeye Name: [2-(3-bromo-4-methoxy-phenyl)-2-oxo-ethyl] 5-acetylthiophene-2-carboxylate CAS Name: 5-acetyl-2-thiophenecarboxylic acid [2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] 5-acetylthiophene-2-carboxylate Traditional Name: 5-acetylthiophene-2-carboxylic acid [2-(3-bromo-4-methoxy-phenyl)-2-keto-ethyl] ester Formula: C16H13BrO5S MolecularWeight: 397.24042

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C(=O)OCC(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CC(=O)C1=CC=C(S1)C(=O)OCC(=O)C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C16H13BrO5S/c1-9(18)14-5-6-15(23-14)16(20)22-8-12(19)10-3-4-13(21-2)11(17)7-10/h3-7H,8H2,1-2H3