4-[4-methyl-5-(3-oxidanylidenebutyl)thiophen-2-yl]butan-2-one

Systemtic Name: 4-[4-methyl-5-(3-oxidanylidenebutyl)thiophen-2-yl]butan-2-one Openeye Name: 4-[4-methyl-5-(3-oxobutyl)-2-thienyl]butan-2-one CAS Name: 4-[4-methyl-5-(3-oxobutyl)-2-thiophenyl]-2-butanone IUPAC Name: 4-[4-methyl-5-(3-oxobutyl)thiophen-2-yl]butan-2-one Traditional Name: 4-[5-(3-ketobutyl)-4-methyl-2-thienyl]butan-2-one Formula: C13H18O2S MolecularWeight: 238.34582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)CCC(=O)C)CCC(=O)C

Isomeric SMILES

CC1=C(SC(=C1)CCC(=O)C)CCC(=O)C

InChI

InChI=1S/C13H18O2S/c1-9-8-12(6-4-10(2)14)16-13(9)7-5-11(3)15/h8H,4-7H2,1-3H3