1-(3,3-dimethyl-2H-1-benzofuran-5-yl)butan-1-one

Systemtic Name: 1-(3,3-dimethyl-2H-1-benzofuran-5-yl)butan-1-one Openeye Name: 1-(3,3-dimethyl-2H-benzofuran-5-yl)butan-1-one CAS Name: 1-(3,3-dimethyl-2H-benzofuran-5-yl)-1-butanone IUPAC Name: 1-(3,3-dimethyl-2H-1-benzofuran-5-yl)butan-1-one Traditional Name: 1-(3,3-dimethylcoumaran-5-yl)butan-1-one Formula: C14H18O2 MolecularWeight: 218.29152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)OCC2(C)C

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)OCC2(C)C

InChI

InChI=1S/C14H18O2/c1-4-5-12(15)10-6-7-13-11(8-10)14(2,3)9-16-13/h6-8H,4-5,9H2,1-3H3