[1-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl] 4-cyanobenzoate

Systemtic Name: [1-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl] 4-cyanobenzoate Openeye Name: [2-(4-chlorophenyl)-1-methyl-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [1-(4-chlorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-chlorophenyl)-1-oxopropan-2-yl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-(4-chlorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C17H12ClNO3 MolecularWeight: 313.73508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)Cl)OC(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)Cl)OC(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H12ClNO3/c1-11(16(20)13-6-8-15(18)9-7-13)22-17(21)14-4-2-12(10-19)3-5-14/h2-9,11H,1H3