tert-butyl 5-(2-bromanyl-3-oxidanylidene-propyl)thiophene-2-carboxylate

Systemtic Name: tert-butyl 5-(2-bromanyl-3-oxidanylidene-propyl)thiophene-2-carboxylate Openeye Name: tert-butyl 5-(2-bromo-3-oxo-propyl)thiophene-2-carboxylate CAS Name: 5-(2-bromo-3-oxopropyl)-2-thiophenecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(2-bromo-3-oxopropyl)thiophene-2-carboxylate Traditional Name: 5-(2-bromo-3-keto-propyl)thiophene-2-carboxylic acid tert-butyl ester Formula: C12H15BrO3S MolecularWeight: 319.2147

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15BrO3S/c1-12(2,3)16-11(15)10-5-4-9(17-10)6-8(13)7-14/h4-5,7-8H,6H2,1-3H3