(3-tert-butyl-4-cyano-cyclohexen-1-yl) ethanoate

Systemtic Name: (3-tert-butyl-4-cyano-cyclohexen-1-yl) ethanoate Openeye Name: (3-tert-butyl-4-cyano-cyclohexen-1-yl) acetate CAS Name: acetic acid (3-tert-butyl-4-cyano-1-cyclohexenyl) ester IUPAC Name: (3-tert-butyl-4-cyanocyclohexen-1-yl) acetate Traditional Name: acetic acid (3-tert-butyl-4-cyano-cyclohexen-1-yl) ester Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(C(CC1)C#N)C(C)(C)C

Isomeric SMILES

CC(=O)OC1=CC(C(CC1)C#N)C(C)(C)C

InChI

InChI=1S/C13H19NO2/c1-9(15)16-11-6-5-10(8-14)12(7-11)13(2,3)4/h7,10,12H,5-6H2,1-4H3