3-methyl-1-[5-(phenylmethyl)thiophen-2-yl]butan-1-one

Systemtic Name: 3-methyl-1-[5-(phenylmethyl)thiophen-2-yl]butan-1-one Openeye Name: 1-(5-benzyl-2-thienyl)-3-methyl-butan-1-one CAS Name: 3-methyl-1-[5-(phenylmethyl)-2-thiophenyl]-1-butanone IUPAC Name: 1-(5-benzylthiophen-2-yl)-3-methylbutan-1-one Traditional Name: 1-(5-benzyl-2-thienyl)-3-methyl-butan-1-one Formula: C16H18OS MolecularWeight: 258.37852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C1=CC=C(S1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(=O)C1=CC=C(S1)CC2=CC=CC=C2

InChI

InChI=1S/C16H18OS/c1-12(2)10-15(17)16-9-8-14(18-16)11-13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3