2-[3-(5-methylfuran-2-yl)butyl]propanedinitrile

Systemtic Name: 2-[3-(5-methylfuran-2-yl)butyl]propanedinitrile Openeye Name: 2-[3-(5-methyl-2-furyl)butyl]propanedinitrile CAS Name: 2-[3-(5-methyl-2-furanyl)butyl]propanedinitrile IUPAC Name: 2-[3-(5-methylfuran-2-yl)butyl]propanedinitrile Traditional Name: 2-[3-(5-methyl-2-furyl)butyl]malononitrile Formula: C12H14N2O MolecularWeight: 202.25236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(C)CCC(C#N)C#N

Isomeric SMILES

CC1=CC=C(O1)C(C)CCC(C#N)C#N

InChI

InChI=1S/C12H14N2O/c1-9(3-5-11(7-13)8-14)12-6-4-10(2)15-12/h4,6,9,11H,3,5H2,1-2H3