(4-cyanophenyl) 6-bromanylhexanoate

Systemtic Name: (4-cyanophenyl) 6-bromanylhexanoate Openeye Name: (4-cyanophenyl) 6-bromohexanoate CAS Name: 6-bromohexanoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 6-bromohexanoate Traditional Name: 6-bromohexanoic acid (4-cyanophenyl) ester Formula: C13H14BrNO2 MolecularWeight: 296.15976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OC(=O)CCCCCBr

Isomeric SMILES

C1=CC(=CC=C1C#N)OC(=O)CCCCCBr

InChI

InChI=1S/C13H14BrNO2/c14-9-3-1-2-4-13(16)17-12-7-5-11(10-15)6-8-12/h5-8H,1-4,9H2