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(2,6-dimethylphenyl) 4-cyanobenzoate

(2,6-dimethylphenyl) 4-cyanobenzoate

Systemtic Name:(2,6-dimethylphenyl) 4-cyanobenzoate
Openeye Name:(2,6-dimethylphenyl) 4-cyanobenzoate
CAS Name:4-cyanobenzoic acid (2,6-dimethylphenyl) ester
IUPAC Name:(2,6-dimethylphenyl) 4-cyanobenzoate
Traditional Name:4-cyanobenzoic acid (2,6-dimethylphenyl) ester
Formula: C16H13NO2
MolecularWeight: 251.27992
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C16H13NO2/c1-11-4-3-5-12(2)15(11)19-16(18)14-8-6-13(10-17)7-9-14/h3-9H,1-2H3


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