(1-cyano-6-ethyl-cyclohexa-2,4-dien-1-yl) ethanoate

Systemtic Name: (1-cyano-6-ethyl-cyclohexa-2,4-dien-1-yl) ethanoate Openeye Name: (1-cyano-6-ethyl-cyclohexa-2,4-dien-1-yl) acetate CAS Name: acetic acid (1-cyano-6-ethyl-1-cyclohexa-2,4-dienyl) ester IUPAC Name: (1-cyano-6-ethylcyclohexa-2,4-dien-1-yl) acetate Traditional Name: acetic acid (1-cyano-6-ethyl-cyclohexa-2,4-dien-1-yl) ester Formula: C11H13NO2 MolecularWeight: 191.22642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C=CC=CC1(C#N)OC(=O)C

Isomeric SMILES

CCC1C=CC=CC1(C#N)OC(=O)C

InChI

InChI=1S/C11H13NO2/c1-3-10-6-4-5-7-11(10,8-12)14-9(2)13/h4-7,10H,3H2,1-2H3