3,3-dimethyl-1-[[2-(phenylcarbonyl)-1-benzothiophen-3-yl]oxy]butan-2-one

Systemtic Name: 3,3-dimethyl-1-[[2-(phenylcarbonyl)-1-benzothiophen-3-yl]oxy]butan-2-one Openeye Name: 1-(2-benzoylbenzothiophen-3-yl)oxy-3,3-dimethyl-butan-2-one CAS Name: 1-[(2-benzoyl-1-benzothiophen-3-yl)oxy]-3,3-dimethyl-2-butanone IUPAC Name: 1-[(2-benzoyl-1-benzothiophen-3-yl)oxy]-3,3-dimethylbutan-2-one Traditional Name: 1-(2-benzoylbenzothiophen-3-yl)oxy-3,3-dimethyl-butan-2-one Formula: C21H20O3S MolecularWeight: 352.4467

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC1=C(SC2=CC=CC=C21)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)COC1=C(SC2=CC=CC=C21)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H20O3S/c1-21(2,3)17(22)13-24-19-15-11-7-8-12-16(15)25-20(19)18(23)14-9-5-4-6-10-14/h4-12H,13H2,1-3H3