1-(5-chloranylthiophen-2-yl)-3,5,5-trimethyl-hexan-1-one

Systemtic Name: 1-(5-chloranylthiophen-2-yl)-3,5,5-trimethyl-hexan-1-one Openeye Name: 1-(5-chloro-2-thienyl)-3,5,5-trimethyl-hexan-1-one CAS Name: 1-(5-chloro-2-thiophenyl)-3,5,5-trimethyl-1-hexanone IUPAC Name: 1-(5-chlorothiophen-2-yl)-3,5,5-trimethylhexan-1-one Traditional Name: 1-(5-chloro-2-thienyl)-3,5,5-trimethyl-hexan-1-one Formula: C13H19ClOS MolecularWeight: 258.80736

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1=CC=C(S1)Cl)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)C1=CC=C(S1)Cl)CC(C)(C)C

InChI

InChI=1S/C13H19ClOS/c1-9(8-13(2,3)4)7-10(15)11-5-6-12(14)16-11/h5-6,9H,7-8H2,1-4H3