3-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]propanenitrile

Systemtic Name: 3-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]propanenitrile Openeye Name: 3-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]propanenitrile CAS Name: 3-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]propanenitrile IUPAC Name: 3-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]propanenitrile Traditional Name: 3-(2,2-dimethylcoumaran-7-yl)oxypropionitrile Formula: C13H15NO2 MolecularWeight: 217.2637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OCCC#N)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OCCC#N)C

InChI

InChI=1S/C13H15NO2/c1-13(2)9-10-5-3-6-11(12(10)16-13)15-8-4-7-14/h3,5-6H,4,8-9H2,1-2H3