(phenylmethyl) (E)-2-cyano-4-ethyl-hex-2-enoate

Systemtic Name: (phenylmethyl) (E)-2-cyano-4-ethyl-hex-2-enoate Openeye Name: benzyl (E)-2-cyano-4-ethyl-hex-2-enoate CAS Name: (E)-2-cyano-4-ethyl-2-hexenoic acid (phenylmethyl) ester IUPAC Name: benzyl (E)-2-cyano-4-ethylhex-2-enoate Traditional Name: (E)-2-cyano-4-ethyl-hex-2-enoic acid benzyl ester Formula: C16H19NO2 MolecularWeight: 257.32756

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C=C(C#N)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCC(CC)/C=C(\C#N)/C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H19NO2/c1-3-13(4-2)10-15(11-17)16(18)19-12-14-8-6-5-7-9-14/h5-10,13H,3-4,12H2,1-2H3/b15-10+