(2-methylphenyl)methyl 4-cyanobenzoate

Systemtic Name: (2-methylphenyl)methyl 4-cyanobenzoate Openeye Name: o-tolylmethyl 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid (2-methylbenzyl) ester Formula: C16H13NO2 MolecularWeight: 251.27992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=CC=CC=C1COC(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H13NO2/c1-12-4-2-3-5-15(12)11-19-16(18)14-8-6-13(10-17)7-9-14/h2-9H,11H2,1H3