(2E)-5-bromanyl-2-(3-methylbut-2-enylidene)thiophen-3-one

Systemtic Name: (2E)-5-bromanyl-2-(3-methylbut-2-enylidene)thiophen-3-one Openeye Name: (2E)-5-bromo-2-(3-methylbut-2-enylidene)thiophen-3-one CAS Name: (2E)-5-bromo-2-(3-methylbut-2-enylidene)-3-thiophenone IUPAC Name: (2E)-5-bromo-2-(3-methylbut-2-enylidene)thiophen-3-one Traditional Name: (2E)-5-bromo-2-(3-methylbut-2-enylidene)thiophen-3-one Formula: C9H9BrOS MolecularWeight: 245.13616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC=C1C(=O)C=C(S1)Br)C

Isomeric SMILES

CC(=C/C=C/1\C(=O)C=C(S1)Br)C

InChI

InChI=1S/C9H9BrOS/c1-6(2)3-4-8-7(11)5-9(10)12-8/h3-5H,1-2H3/b8-4+