(2,5-dimethylphenyl)methyl 3-cyanobenzoate

Systemtic Name: (2,5-dimethylphenyl)methyl 3-cyanobenzoate Openeye Name: (2,5-dimethylphenyl)methyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid (2,5-dimethylbenzyl) ester Formula: C17H15NO2 MolecularWeight: 265.3065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C17H15NO2/c1-12-6-7-13(2)16(8-12)11-20-17(19)15-5-3-4-14(9-15)10-18/h3-9H,11H2,1-2H3