(4-cyanophenyl) 2-ethylhexanoate

Systemtic Name: (4-cyanophenyl) 2-ethylhexanoate Openeye Name: (4-cyanophenyl) 2-ethylhexanoate CAS Name: 2-ethylhexanoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 2-ethylhexanoate Traditional Name: 2-ethylhexanoic acid (4-cyanophenyl) ester Formula: C15H19NO2 MolecularWeight: 245.31686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO2/c1-3-5-6-13(4-2)15(17)18-14-9-7-12(11-16)8-10-14/h7-10,13H,3-6H2,1-2H3