(4-chloranyl-3,5-dimethyl-phenyl) 4,5-bis(bromanyl)thiophene-2-carboxylate

Systemtic Name: (4-chloranyl-3,5-dimethyl-phenyl) 4,5-bis(bromanyl)thiophene-2-carboxylate Openeye Name: (4-chloro-3,5-dimethyl-phenyl) 4,5-dibromothiophene-2-carboxylate CAS Name: 4,5-dibromo-2-thiophenecarboxylic acid (4-chloro-3,5-dimethylphenyl) ester IUPAC Name: (4-chloro-3,5-dimethylphenyl) 4,5-dibromothiophene-2-carboxylate Traditional Name: 4,5-dibromothiophene-2-carboxylic acid (4-chloro-3,5-dimethyl-phenyl) ester Formula: C13H9Br2ClO2S MolecularWeight: 424.53536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC(=O)C2=CC(=C(S2)Br)Br

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC(=O)C2=CC(=C(S2)Br)Br

InChI

InChI=1S/C13H9Br2ClO2S/c1-6-3-8(4-7(2)11(6)16)18-13(17)10-5-9(14)12(15)19-10/h3-5H,1-2H3