4-bromanyl-2,5-ditert-butyl-thiophene-3-carboxylate

Systemtic Name: 4-bromanyl-2,5-ditert-butyl-thiophene-3-carboxylate Openeye Name: 4-bromo-2,5-ditert-butyl-thiophene-3-carboxylate CAS Name: 4-bromo-2,5-ditert-butyl-3-thiophenecarboxylate IUPAC Name: 4-bromo-2,5-ditert-butylthiophene-3-carboxylate Traditional Name: 4-bromo-2,5-ditert-butyl-3-thenoate Formula: C13H18BrO2S- MolecularWeight: 318.24982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=C(S1)C(C)(C)C)Br)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=C(C(=C(S1)C(C)(C)C)Br)C(=O)[O-]

InChI

InChI=1S/C13H19BrO2S/c1-12(2,3)9-7(11(15)16)8(14)10(17-9)13(4,5)6/h1-6H3,(H,15,16)/p-1