[2-oxidanylidene-2-(4-propan-2-ylphenyl)ethyl] 4-cyanobenzoate

Systemtic Name: [2-oxidanylidene-2-(4-propan-2-ylphenyl)ethyl] 4-cyanobenzoate Openeye Name: [2-(4-isopropylphenyl)-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-oxo-2-(4-propan-2-ylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-propan-2-ylphenyl)ethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid (2-keto-2-p-cumenyl-ethyl) ester Formula: C19H17NO3 MolecularWeight: 307.34318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17NO3/c1-13(2)15-7-9-16(10-8-15)18(21)12-23-19(22)17-5-3-14(11-20)4-6-17/h3-10,13H,12H2,1-2H3