[2-oxidanylidene-2-(2,3,4,5-tetramethylphenyl)ethyl] 4-cyanobenzoate

Systemtic Name: [2-oxidanylidene-2-(2,3,4,5-tetramethylphenyl)ethyl] 4-cyanobenzoate Openeye Name: [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-keto-2-(2,3,4,5-tetramethylphenyl)ethyl] ester Formula: C20H19NO3 MolecularWeight: 321.36976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C(=O)COC(=O)C2=CC=C(C=C2)C#N)C)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1)C(=O)COC(=O)C2=CC=C(C=C2)C#N)C)C)C

InChI

InChI=1S/C20H19NO3/c1-12-9-18(15(4)14(3)13(12)2)19(22)11-24-20(23)17-7-5-16(10-21)6-8-17/h5-9H,11H2,1-4H3