(1-oxidanylidene-1-phenyl-propan-2-yl) 3-cyanobenzoate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 3-cyanobenzoate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C17H13NO3 MolecularWeight: 279.29002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13NO3/c1-12(16(19)14-7-3-2-4-8-14)21-17(20)15-9-5-6-13(10-15)11-18/h2-10,12H,1H3