[2-oxidanylidene-2-(4-propan-2-ylphenyl)ethyl] (2S)-2-(4-cyanophenoxy)propanoate

Systemtic Name: [2-oxidanylidene-2-(4-propan-2-ylphenyl)ethyl] (2S)-2-(4-cyanophenoxy)propanoate Openeye Name: [2-(4-isopropylphenyl)-2-oxo-ethyl] (2S)-2-(4-cyanophenoxy)propanoate CAS Name: (2S)-2-(4-cyanophenoxy)propanoic acid [2-oxo-2-(4-propan-2-ylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-propan-2-ylphenyl)ethyl] (2S)-2-(4-cyanophenoxy)propanoate Traditional Name: (2S)-2-(4-cyanophenoxy)propionic acid (2-keto-2-p-cumenyl-ethyl) ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)COC(=O)C(C)OC2=CC=C(C=C2)C#N

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)C1=CC=C(C=C1)C(C)C)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H21NO4/c1-14(2)17-6-8-18(9-7-17)20(23)13-25-21(24)15(3)26-19-10-4-16(12-22)5-11-19/h4-11,14-15H,13H2,1-3H3/t15-/m0/s1