[1-(4-chlorophenyl)-1-cyano-propan-2-yl] ethanoate

Systemtic Name: [1-(4-chlorophenyl)-1-cyano-propan-2-yl] ethanoate Openeye Name: [2-(4-chlorophenyl)-2-cyano-1-methyl-ethyl] acetate CAS Name: acetic acid [1-(4-chlorophenyl)-1-cyanopropan-2-yl] ester IUPAC Name: [1-(4-chlorophenyl)-1-cyanopropan-2-yl] acetate Traditional Name: acetic acid [2-(4-chlorophenyl)-2-cyano-1-methyl-ethyl] ester Formula: C12H12ClNO2 MolecularWeight: 237.68218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C#N)C1=CC=C(C=C1)Cl)OC(=O)C

Isomeric SMILES

CC(C(C#N)C1=CC=C(C=C1)Cl)OC(=O)C

InChI

InChI=1S/C12H12ClNO2/c1-8(16-9(2)15)12(7-14)10-3-5-11(13)6-4-10/h3-6,8,12H,1-2H3