1-[2,5-bis(bromanyl)thiophen-3-yl]-3,5,5-trimethyl-hexan-1-one

Systemtic Name: 1-[2,5-bis(bromanyl)thiophen-3-yl]-3,5,5-trimethyl-hexan-1-one Openeye Name: 1-(2,5-dibromo-3-thienyl)-3,5,5-trimethyl-hexan-1-one CAS Name: 1-(2,5-dibromo-3-thiophenyl)-3,5,5-trimethyl-1-hexanone IUPAC Name: 1-(2,5-dibromothiophen-3-yl)-3,5,5-trimethylhexan-1-one Traditional Name: 1-(2,5-dibromo-3-thienyl)-3,5,5-trimethyl-hexan-1-one Formula: C13H18Br2OS MolecularWeight: 382.15442

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1=C(SC(=C1)Br)Br)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)C1=C(SC(=C1)Br)Br)CC(C)(C)C

InChI

InChI=1S/C13H18Br2OS/c1-8(7-13(2,3)4)5-10(16)9-6-11(14)17-12(9)15/h6,8H,5,7H2,1-4H3