(4-cyanophenyl) octanoate

Systemtic Name: (4-cyanophenyl) octanoate Openeye Name: (4-cyanophenyl) octanoate CAS Name: octanoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) octanoate Traditional Name: caprylic acid (4-cyanophenyl) ester Formula: C15H19NO2 MolecularWeight: 245.31686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=CC=C(C=C1)C#N

Isomeric SMILES

CCCCCCCC(=O)OC1=CC=C(C=C1)C#N

InChI

InChI=1S/C15H19NO2/c1-2-3-4-5-6-7-15(17)18-14-10-8-13(12-16)9-11-14/h8-11H,2-7H2,1H3