(3-cyanophenyl)methyl 4-cyanobenzoate

Systemtic Name: (3-cyanophenyl)methyl 4-cyanobenzoate Openeye Name: (3-cyanophenyl)methyl 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid (3-cyanobenzyl) ester Formula: C16H10N2O2 MolecularWeight: 262.2628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10N2O2/c17-9-12-4-6-15(7-5-12)16(19)20-11-14-3-1-2-13(8-14)10-18/h1-8H,11H2