1-(3-bromanylthiophen-2-yl)-2-(4-methylpentoxy)ethanone

Systemtic Name: 1-(3-bromanylthiophen-2-yl)-2-(4-methylpentoxy)ethanone Openeye Name: 1-(3-bromo-2-thienyl)-2-isohexyloxy-ethanone CAS Name: 1-(3-bromo-2-thiophenyl)-2-(4-methylpentoxy)ethanone IUPAC Name: 1-(3-bromothiophen-2-yl)-2-(4-methylpentoxy)ethanone Traditional Name: 1-(3-bromo-2-thienyl)-2-isohexyloxy-ethanone Formula: C12H17BrO2S MolecularWeight: 305.23118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOCC(=O)C1=C(C=CS1)Br

Isomeric SMILES

CC(C)CCCOCC(=O)C1=C(C=CS1)Br

InChI

InChI=1S/C12H17BrO2S/c1-9(2)4-3-6-15-8-11(14)12-10(13)5-7-16-12/h5,7,9H,3-4,6,8H2,1-2H3