(phenylmethyl) 2-cyano-2-(4-cyanophenyl)ethanoate

Systemtic Name: (phenylmethyl) 2-cyano-2-(4-cyanophenyl)ethanoate Openeye Name: benzyl 2-cyano-2-(4-cyanophenyl)acetate CAS Name: 2-cyano-2-(4-cyanophenyl)acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-cyano-2-(4-cyanophenyl)acetate Traditional Name: 2-cyano-2-(4-cyanophenyl)acetic acid benzyl ester Formula: C17H12N2O2 MolecularWeight: 276.28938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12N2O2/c18-10-13-6-8-15(9-7-13)16(11-19)17(20)21-12-14-4-2-1-3-5-14/h1-9,16H,12H2