(5S)-5-(1-bromanyl-2-methyl-but-3-enyl)-4-methoxy-3,5-dimethyl-thiophen-2-one

Systemtic Name: (5S)-5-(1-bromanyl-2-methyl-but-3-enyl)-4-methoxy-3,5-dimethyl-thiophen-2-one Openeye Name: (5S)-5-(1-bromo-2-methyl-but-3-enyl)-4-methoxy-3,5-dimethyl-thiophen-2-one CAS Name: (5S)-5-(1-bromo-2-methylbut-3-enyl)-4-methoxy-3,5-dimethyl-2-thiophenone IUPAC Name: (5S)-5-(1-bromo-2-methylbut-3-enyl)-4-methoxy-3,5-dimethylthiophen-2-one Traditional Name: (5S)-5-(1-bromo-2-methyl-but-3-enyl)-4-methoxy-3,5-dimethyl-thiophen-2-one Formula: C12H17BrO2S MolecularWeight: 305.23118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(SC1=O)(C)C(C(C)C=C)Br)OC

Isomeric SMILES

CC1=C([C@@](SC1=O)(C)C(C(C)C=C)Br)OC

InChI

InChI=1S/C12H17BrO2S/c1-6-7(2)9(13)12(4)10(15-5)8(3)11(14)16-12/h6-7,9H,1H2,2-5H3/t7?,9?,12-/m1/s1